Output file : 1L2Y_REMD.out_GB000
Sidechain potential file :
- /users/adam/unres//PARAM/sc_GB_opt.1e0g-52-17k-2k-newclass-shan1e9_gap8g-sc
- SCp potential file : /users/adam/unres//PARAM/scp.parm
- Electrostatic potential file : /users/adam/unres//PARAM/electr_631Gdp.parm
+ /users/pk376/unres-git/unres/PARAM/sc_GB_opt.1e0g-52-17k-2k-newclass-shan1e9_ga
+ p8g-sc
+ SCp potential file : /users/pk376/unres-git/unres/PARAM/scp.parm
+ Electrostatic potential file :
+ /users/pk376/unres-git/unres/PARAM/electr_631Gdp.parm
Cumulant coefficient file :
- /users/adam/unres//PARAM/fourier_opt.parm.1igd_hc_iter3_3
- Torsional parameter file : /users/adam/unres//PARAM/torsion_631Gdp.parm
+ /users/pk376/unres-git/unres/PARAM/fourier_opt.parm.1igd_hc_iter3_3
+ Torsional parameter file :
+ /users/pk376/unres-git/unres/PARAM/torsion_631Gdp.parm
Double torsional parameter file :
- /users/adam/unres//PARAM/torsion_double_631Gdp.parm
- SCCOR parameter file : /users/adam/unres//PARAM/rotcorr_AM1.parm
- Bond & inertia constant file : /users/adam/unres//PARAM/bond.parm
- Bending parameter file : /users/adam/unres//PARAM/thetaml.5parm
- Rotamer parameter file : /users/adam/unres//PARAM/scgauss.parm
- Threading database : /users/adam/unres//PARAM/patterns.cart
+ /users/pk376/unres-git/unres/PARAM/torsion_double_631Gdp.parm
+ SCCOR parameter file : /users/pk376/unres-git/unres/PARAM/sccor_pdb_shelly.dat
+ Bond & inertia constant file : /users/pk376/unres-git/unres/PARAM/bond.parm
+ Bending parameter file :
+ /users/pk376/unres-git/unres/PARAM/thetaml.5parm
+ Rotamer parameter file :
+ /users/pk376/unres-git/unres/PARAM/scgauss.parm
+ Threading database :
+ /users/pk376/unres-git/unres/PARAM/patterns.cart
--------------------------------------------------------------------------------
********************************************************************************
United-residue force field calculation - parallel job.
********************************************************************************
### LAST MODIFIED 03/28/12 23:29 by czarek
++++ Compile info ++++
- Version 2.5 build 62
- compiled Sun May 13 16:07:22 2012
- compiled by adam@matrix.chem.cornell.edu
+ Version 2.5 build 302
+ compiled Mon Jul 23 17:42:12 2012
+ compiled by jal47@matrix.chem.cornell.edu
OS name: Linux
OS release: 2.6.34.9-69.fc13.x86_64
OS version: #1 SMP Tue May 3 09:23:03 UTC 2011
flags:
INSTALL_DIR = /users/software/mpich-1.2.7p1_int...
FC= ifort
- OPT = -O3 -ip -w
+ OPT = -g -ip -w -CB
FFLAGS = -c ${OPT} -I$(INSTALL_DIR)/include
FFLAGS1 = -c -w -g -d2 -CA -CB -I$(INSTALL_DIR)...
FFLAGS2 = -c -w -g -O0 -I$(INSTALL_DIR)/include
Calling chainbuild
Calling REMD
- MREMD 16 time before 1.171875000000000E-002
+ MREMD 16 time before 2.343750000000000E-002
NREP= 16
i2rep 1 2 3 4 5 6 7 8 9 10
11 12 13 14 15 16
22 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000
Calling the zero-angular momentum subroutine
vcm right after adjustment:
- -1.347581050579500E-017 1.082148419404750E-017 4.083578941150001E-018
+ 2.286804207044001E-017 1.061730524699000E-017 -3.266863152920001E-018
alpha-carbon coordinates centroid coordinates
maximum acceleration 7.10627E-01
- Setup time 1.562500000000000E-002
- acceleration/energy drift too large 6.01872884619312
- 20.2592193938126 split increased to 2 itime 139
+ Setup time 6.250000000000000E-002
+ acceleration/energy drift too large 6.01872884623843
+ 20.2592193941127 split increased to 2 itime 139
itsplit 1
- acceleration/energy drift too large 4.74983079650855
- 19.5228610395193 split increased to 2 itime 766
+ acceleration/energy drift too large 5.27112114968694
+ 24.5947094282993 split increased to 2 itime 811
itsplit 1
- acceleration/energy drift too large 2.42980134136891
- 12.0406014227438 split increased to 2 itime 814
+ acceleration/energy drift too large 4.11749741993015
+ 10.0233573756981 split increased to 2 itime 812
itsplit 1
- acceleration/energy drift too large 2.72440113412620
- 19.5377049768865 split increased to 2 itime 1721
+ acceleration/energy drift too large 6.78156239205624
+ 46.6376162381685 split increased to 2 itime 1036
itsplit 1
- acceleration/energy drift too large 3.15919805676186
- 13.6416206054045 split increased to 2 itime 2159
+ acceleration/energy drift too large 9.31079499697821
+ 31.7226708145899 split increased to 2 itime 2891
itsplit 1
- acceleration/energy drift too large 4.49925170174960
- 12.6486736453362 split increased to 2 itime 2764
+ acceleration/energy drift too large 6.21988967563635
+ 16.7074784854902 split increased to 2 itime 3759
itsplit 1
- acceleration/energy drift too large 4.96902320146049
- 15.8249185775960 split increased to 2 itime 2803
+ acceleration/energy drift too large 1.80361188606243
+ 12.1415737284860 split increased to 2 itime 4945
itsplit 1
- acceleration/energy drift too large 3.86936220846959
- 19.0168887838164 split increased to 2 itime 3803
+ acceleration/energy drift too large 5.12402735643209
+ 29.4650551506901 split increased to 2 itime 5095
itsplit 1
- acceleration/energy drift too large 7.20491206720874
- 20.9721304471975 split increased to 2 itime 5165
+ acceleration/energy drift too large 2.83404312115991
+ 14.2652706563271 split increased to 2 itime 5279
itsplit 1
- acceleration/energy drift too large 2.84166893514261
- 10.1117521454467 split increased to 2 itime 6122
+ acceleration/energy drift too large 3.34004923031108
+ 13.9147219048335 split increased to 2 itime 5456
itsplit 1
- acceleration/energy drift too large 3.05143756190817
- 10.6364332980644 split increased to 2 itime 6901
+ acceleration/energy drift too large 3.94199203323793
+ 14.7105414366802 split increased to 2 itime 5684
itsplit 1
- acceleration/energy drift too large 7.70123589522393
- 23.7935036895577 split increased to 2 itime 7340
+ acceleration/energy drift too large 4.58176126929386
+ 18.9652642544041 split increased to 2 itime 6659
itsplit 1
-Velocities reset to random values, time 1999.80
- acceleration/energy drift too large 11.6354071599874
- 51.5009864640833 split increased to 2 itime 11808
+ acceleration/energy drift too large 4.23308137134488
+ 20.0605747926315 split increased to 2 itime 7737
itsplit 1
- acceleration/energy drift too large 5.28327594999131
- 11.1128643695182 split increased to 2 itime 12607
+ acceleration/energy drift too large 5.69874662777226
+ 13.1487157869994 split increased to 2 itime 8176
itsplit 1
- acceleration/energy drift too large 2.38140641277758
- 19.1079051686024 split increased to 2 itime 13445
+ acceleration/energy drift too large 8.80799290368255
+ 36.1731351413900 split increased to 2 itime 8328
itsplit 1
- acceleration/energy drift too large 12.2496712383343
- 64.9847489681614 split increased to 2 itime 13548
+ acceleration/energy drift too large 4.83324003078720
+ 10.4766940200828 split increased to 2 itime 8736
itsplit 1
- acceleration/energy drift too large 7.44377174513165
- 22.7667228358058 split increased to 2 itime 13650
+ acceleration/energy drift too large 2.74481026144746
+ 15.5635977279567 split increased to 2 itime 9154
itsplit 1
- acceleration/energy drift too large 4.20125556520394
- 10.2171757103044 split increased to 2 itime 14207
+Velocities reset to random values, time 1999.80
+ acceleration/energy drift too large 14.0404045922975
+ 68.7798479910309 split increased to 2 itime 10160
itsplit 1
- acceleration/energy drift too large 6.60707563004684
- 18.8934595483807 split increased to 2 itime 14677
+ acceleration/energy drift too large 1.50316818806266
+ 10.5002113048853 split increased to 2 itime 10590
itsplit 1
- acceleration/energy drift too large 7.45216174819551
- 24.4938606702042 split increased to 2 itime 15132
+ acceleration/energy drift too large 5.43166515803004
+ 13.9130864336143 split increased to 2 itime 11052
itsplit 1
- acceleration/energy drift too large 6.99505557934837
- 18.7047318940532 split increased to 2 itime 17282
+ acceleration/energy drift too large 4.18833595053208
+ 22.5560767264168 split increased to 2 itime 12025
itsplit 1
- acceleration/energy drift too large 2.23930018536109
- 11.7694706486093 split increased to 2 itime 18194
+ acceleration/energy drift too large 5.05652196479640
+ 14.4921485139768 split increased to 2 itime 13325
itsplit 1
-Velocities reset to random values, time 3999.80
- acceleration/energy drift too large 5.47563395191991
- 14.2572925849945 split increased to 2 itime 21244
+ acceleration/energy drift too large 4.45939796981960
+ 16.5366763212833 split increased to 2 itime 15176
itsplit 1
- acceleration/energy drift too large 3.62604081748416
- 17.0476062181967 split increased to 2 itime 21484
+ acceleration/energy drift too large 2.65463078527267
+ 16.4090157418096 split increased to 2 itime 16444
itsplit 1
- acceleration/energy drift too large 2.97846143694444
- 10.9929107295660 split increased to 2 itime 21624
+ acceleration/energy drift too large 4.83718887683354
+ 14.1174528410817 split increased to 2 itime 17097
itsplit 1
- acceleration/energy drift too large 9.48302167983757
- 45.8513332274356 split increased to 2 itime 22122
+ acceleration/energy drift too large 6.31119970893411
+ 16.8460396165817 split increased to 2 itime 19697
itsplit 1
- acceleration/energy drift too large 10.8638437029045
- 58.6303764307960 split increased to 2 itime 22356
+ acceleration/energy drift too large 4.02987312329386
+ 10.3471546915559 split increased to 2 itime 19819
itsplit 1
- acceleration/energy drift too large 2.54163811597567
- 13.2808399968031 split increased to 4 itime 22356
- itsplit 2
- acceleration/energy drift too large 5.07305132246483
- 24.6932332171085 split increased to 2 itime 23194
+ acceleration/energy drift too large 3.99202782706859
+ 10.0203344095428 split increased to 2 itime 19834
+ itsplit 1
+Velocities reset to random values, time 3999.80
+ acceleration/energy drift too large 6.16108168523388
+ 17.6884977232375 split increased to 2 itime 22438
itsplit 1
- acceleration/energy drift too large 3.00493628697445
- 18.2020936055883 split increased to 2 itime 23501
+ acceleration/energy drift too large 2.32814200502473
+ 10.4235372979880 split increased to 4 itime 22438
itsplit 1
- acceleration/energy drift too large 4.78046968888152
- 16.3911739319017 split increased to 2 itime 24653
+ acceleration/energy drift too large 6.04820859670261
+ 17.2116778245396 split increased to 2 itime 22949
itsplit 1
- acceleration/energy drift too large 5.51863359670277
- 21.6434203108233 split increased to 2 itime 26334
+ acceleration/energy drift too large 9.39321822080475
+ 40.3009380499136 split increased to 2 itime 24190
itsplit 1
- acceleration/energy drift too large 3.96579870857696
- 13.8237246202860 split increased to 2 itime 26485
+ acceleration/energy drift too large 12.2349397254060
+ 65.3702132086642 split increased to 2 itime 25430
itsplit 1
- acceleration/energy drift too large 6.12828016734532
- 42.8971634541535 split increased to 2 itime 26752
+ acceleration/energy drift too large 3.56592545350488
+ 18.7333147770938 split increased to 2 itime 26054
itsplit 1
- acceleration/energy drift too large 4.11829826507824
- 15.5402866484302 split increased to 2 itime 26922
+ acceleration/energy drift too large 4.94539499627627
+ 11.7236757967914 split increased to 2 itime 27422
itsplit 1
- acceleration/energy drift too large 6.04002406527162
- 16.7055308519018 split increased to 2 itime 27690
+ acceleration/energy drift too large 6.34859604644822
+ 15.8808952575016 split increased to 2 itime 28830
+ itsplit 1
+ acceleration/energy drift too large 7.97849023708925
+ 18.7636280341567 split increased to 2 itime 29314
itsplit 1
Velocities reset to random values, time 5999.80
- acceleration/energy drift too large 8.38660842869076
- 25.3591960594494 split increased to 2 itime 34178
+ acceleration/energy drift too large 5.71322468319090
+ 13.0840605575853 split increased to 2 itime 30269
+ itsplit 1
+ acceleration/energy drift too large 6.08204819236797
+ 11.5030063880184 split increased to 2 itime 32467
+ itsplit 1
+ acceleration/energy drift too large 4.62814684819236
+ 15.4269491395818 split increased to 2 itime 33071
itsplit 1
- acceleration/energy drift too large 10.9882246612523
- 58.7557177221095 split increased to 2 itime 36227
+ acceleration/energy drift too large 4.70153961675083
+ 13.2205867635956 split increased to 2 itime 37548
itsplit 1
- acceleration/energy drift too large 5.05659941681037
- 31.8337369644708 split increased to 2 itime 36265
+ acceleration/energy drift too large 4.25311269514877
+ 12.1931048233601 split increased to 2 itime 37870
itsplit 1
Velocities reset to random values, time 7999.80
- acceleration/energy drift too large 2.71434857030693
- 17.4163763879749 split increased to 2 itime 40190
+ acceleration/energy drift too large 3.85720530076065
+ 10.7533701949358 split increased to 2 itime 40923
itsplit 1
- acceleration/energy drift too large 4.30804696366580
- 13.8194511957359 split increased to 2 itime 42937
+ acceleration/energy drift too large 4.70796821872959
+ 10.0261038188810 split increased to 2 itime 42324
itsplit 1
- acceleration/energy drift too large 5.36273804328155
- 14.7019083967302 split increased to 2 itime 46432
+ acceleration/energy drift too large 3.96818438961114
+ 10.8885252102699 split increased to 2 itime 42612
itsplit 1
- acceleration/energy drift too large 5.21978786131259
- 30.1432910261118 split increased to 2 itime 46504
+ acceleration/energy drift too large 4.09393162352054
+ 11.5790376309746 split increased to 2 itime 43050
itsplit 1
- acceleration/energy drift too large 3.99436874867100
- 13.2783035079613 split increased to 2 itime 48239
+ acceleration/energy drift too large 4.11712862523380
+ 11.0072201435151 split increased to 2 itime 44766
itsplit 1
-Velocities reset to random values, time 9999.80
- acceleration/energy drift too large 3.96343649671360
- 11.8225748608274 split increased to 2 itime 50401
+ acceleration/energy drift too large 2.35382036918792
+ 13.3099228493673 split increased to 2 itime 45474
+ itsplit 1
+ acceleration/energy drift too large 1.94630935135251
+ 10.9177661801165 split increased to 2 itime 46476
itsplit 1
- acceleration/energy drift too large 3.50803757267449
- 12.7784136139136 split increased to 2 itime 51287
+ acceleration/energy drift too large 2.06980925461797
+ 11.8933888628329 split increased to 2 itime 47581
itsplit 1
- acceleration/energy drift too large 6.23134277699863
- 19.9603968582112 split increased to 2 itime 52940
+ acceleration/energy drift too large 9.10461204955003
+ 26.4122572834987 split increased to 2 itime 47995
itsplit 1
- acceleration/energy drift too large 6.51677331640127
- 19.0647823515166 split increased to 2 itime 53907
+ acceleration/energy drift too large 7.65514960946350
+ 16.0520658295329 split increased to 2 itime 48706
itsplit 1
- acceleration/energy drift too large 3.15503159133594
- 11.4554547415408 split increased to 2 itime 53908
+ acceleration/energy drift too large 5.00524961909485
+ 15.1658758532439 split increased to 2 itime 48825
itsplit 1
- acceleration/energy drift too large 6.84515553641081
- 14.3026941075444 split increased to 2 itime 54963
+Velocities reset to random values, time 9999.80
+ acceleration/energy drift too large 4.96256603098756
+ 18.3691428119523 split increased to 2 itime 51876
itsplit 1
- acceleration/energy drift too large 5.20299172981178
- 15.1228442011201 split increased to 2 itime 57697
+ acceleration/energy drift too large 6.17016796366666
+ 21.0175151708704 split increased to 2 itime 53149
itsplit 1
- acceleration/energy drift too large 3.30207550227888
- 23.1093744770291 split increased to 2 itime 58475
+ acceleration/energy drift too large 5.29951934386337
+ 31.9533628880177 split increased to 2 itime 53272
itsplit 1
- acceleration/energy drift too large 4.89942409120106
- 12.1031448388269 split increased to 2 itime 59227
+ acceleration/energy drift too large 4.68375061639108
+ 12.7060473695889 split increased to 2 itime 53395
itsplit 1
- acceleration/energy drift too large 3.17787244403120
- 16.4718673445683 split increased to 2 itime 59781
+ acceleration/energy drift too large 3.20466394431315
+ 19.7717416088959 split increased to 2 itime 53446
+ itsplit 1
+ acceleration/energy drift too large 4.85961281423604
+ 11.0926402202715 split increased to 2 itime 54681
+ itsplit 1
+ acceleration/energy drift too large 4.14153258922024
+ 12.0395465482629 split increased to 2 itime 56699
+ itsplit 1
+ acceleration/energy drift too large 2.72601920768183
+ 12.3525016323719 split increased to 2 itime 58003
+ itsplit 1
+ acceleration/energy drift too large 6.55696556129599
+ 14.2429255435316 split increased to 2 itime 58834
itsplit 1
Velocities reset to random values, time 11999.80
- acceleration/energy drift too large 6.97338281423259
- 17.1968575059626 split increased to 2 itime 65549
+ acceleration/energy drift too large 7.12474949730125
+ 22.0427565925556 split increased to 2 itime 61766
+ itsplit 1
+ acceleration/energy drift too large 4.57337960000594
+ 13.0230047455612 split increased to 2 itime 61925
+ itsplit 1
+ acceleration/energy drift too large 5.02909377016599
+ 11.6681422766353 split increased to 2 itime 62314
itsplit 1
- acceleration/energy drift too large 7.64008965585912
- 25.1540520977120 split increased to 2 itime 66999
+ acceleration/energy drift too large 6.35545410294304
+ 13.7955727228278 split increased to 2 itime 62315
itsplit 1
- acceleration/energy drift too large 9.86056027080071
- 44.9702180104463 split increased to 2 itime 67318
+ acceleration/energy drift too large 3.84637140197231
+ 15.8731664253529 split increased to 2 itime 62390
itsplit 1
- acceleration/energy drift too large 3.21827674595868
- 11.6977308236240 split increased to 2 itime 69680
+ acceleration/energy drift too large 7.51463114258450
+ 37.0097708173328 split increased to 2 itime 62628
+ itsplit 1
+ acceleration/energy drift too large 2.74527858013029
+ 18.5089597227240 split increased to 2 itime 63937
+ itsplit 1
+ acceleration/energy drift too large 3.02629594123442
+ 15.2557094699447 split increased to 2 itime 67453
+ itsplit 1
+ acceleration/energy drift too large 4.88402970109660
+ 12.8773440495137 split increased to 2 itime 67756
itsplit 1
Velocities reset to random values, time 13999.80
- acceleration/energy drift too large 4.30731565909926
- 20.7967818934947 split increased to 2 itime 72030
+ acceleration/energy drift too large 4.64262254089198
+ 12.9253616962702 split increased to 2 itime 70092
+ itsplit 1
+ acceleration/energy drift too large 6.53041013165571
+ 25.3486436718531 split increased to 2 itime 70359
+ itsplit 1
+ acceleration/energy drift too large 7.57807972570140
+ 25.2793900559892 split increased to 2 itime 72857
itsplit 1
- acceleration/energy drift too large 7.83388976415359
- 26.1373163125412 split increased to 2 itime 72712
+ acceleration/energy drift too large 9.29548902353072
+ 42.5960306524631 split increased to 2 itime 72991
itsplit 1
- acceleration/energy drift too large 4.07923425251393
- 11.5761095281845 split increased to 2 itime 73293
+ acceleration/energy drift too large 5.75244529897706
+ 10.9510885251213 split increased to 2 itime 73642
itsplit 1
- acceleration/energy drift too large 7.07820634835438
- 25.5314618601109 split increased to 2 itime 75847
+ acceleration/energy drift too large 11.4395965515086
+ 60.0948035321383 split increased to 2 itime 74388
itsplit 1
- acceleration/energy drift too large 5.30631216749777
- 19.3819517361230 split increased to 2 itime 77813
+ acceleration/energy drift too large 2.22631705367035
+ 11.4713659959425 split increased to 2 itime 76683
itsplit 1
- acceleration/energy drift too large 4.90137388269755
- 21.9389523332814 split increased to 2 itime 78647
+ acceleration/energy drift too large 9.84608215173027
+ 34.3450966126282 split increased to 2 itime 77552
itsplit 1
- acceleration/energy drift too large 4.37302703630593
- 12.8814610195086 split increased to 2 itime 78761
+ acceleration/energy drift too large 4.20929349125431
+ 17.9775830371482 split increased to 2 itime 79436
+ itsplit 1
+ acceleration/energy drift too large 4.61379006684879
+ 20.2989056521177 split increased to 2 itime 79589
itsplit 1
Velocities reset to random values, time 15999.80
- acceleration/energy drift too large 12.5793161019678
- 77.1606597567833 split increased to 2 itime 81690
+ acceleration/energy drift too large 5.50108596343538
+ 10.6878119019872 split increased to 2 itime 80008
itsplit 1
- acceleration/energy drift too large 14.1433369956199
- 83.7077947516374 split increased to 2 itime 81946
+ acceleration/energy drift too large 2.37118338977475
+ 10.3256968971107 split increased to 2 itime 81194
itsplit 1
- acceleration/energy drift too large 4.14781018166589
- 11.7223005932215 split increased to 2 itime 82378
+ acceleration/energy drift too large 4.31667605360844
+ 15.2052353631072 split increased to 2 itime 83700
itsplit 1
- acceleration/energy drift too large 2.59175652275193
- 10.0451105914574 split increased to 2 itime 84005
+ acceleration/energy drift too large 4.82637085599304
+ 23.3381873707151 split increased to 2 itime 84232
itsplit 1
- acceleration/energy drift too large 3.56050764257851
- 19.2265506063186 split increased to 2 itime 85523
+ acceleration/energy drift too large 4.96954630655769
+ 30.7957769669266 split increased to 2 itime 84269
itsplit 1
- acceleration/energy drift too large 2.57060234801271
- 11.5463540288606 split increased to 2 itime 85524
+ acceleration/energy drift too large 3.85455979578227
+ 13.9604757007354 split increased to 2 itime 84376
itsplit 1
- acceleration/energy drift too large 7.06696413701550
- 15.3165037672047 split increased to 2 itime 89847
+ acceleration/energy drift too large 2.67927691395306
+ 12.2165085498758 split increased to 2 itime 86011
itsplit 1
-Velocities reset to random values, time 17999.80
- acceleration/energy drift too large 10.2370360008905
- 48.8123972161011 split increased to 2 itime 94395
+ acceleration/energy drift too large 2.91031747948615
+ 13.1206077770531 split increased to 2 itime 86348
itsplit 1
- acceleration/energy drift too large 2.47298724447893
- 11.4227253581067 split increased to 4 itime 94395
- itsplit 2
- acceleration/energy drift too large 6.12282835799477
- 18.6950582486677 split increased to 2 itime 95973
+ acceleration/energy drift too large 6.77072466643258
+ 18.4549273126829 split increased to 2 itime 88337
itsplit 1
- acceleration/energy drift too large 7.53154738738746
- 26.9331387043654 split increased to 2 itime 96333
+ acceleration/energy drift too large 5.03953151137243
+ 12.7177514592325 split increased to 2 itime 89436
itsplit 1
- acceleration/energy drift too large 7.17138345743283
- 22.1398257918480 split increased to 2 itime 97687
+Velocities reset to random values, time 17999.80
+ acceleration/energy drift too large 2.11777019420856
+ 10.7749222926264 split increased to 2 itime 92164
+ itsplit 1
+ acceleration/energy drift too large 1.90319180289364
+ 10.2714078201419 split increased to 2 itime 94344
itsplit 1
- acceleration/energy drift too large 5.39476831940613
- 14.6186292280039 split increased to 2 itime 98250
+ acceleration/energy drift too large 4.49449982744576
+ 16.6526232289962 split increased to 2 itime 98465
itsplit 1
Velocities reset to random values, time 19999.80
REMD synchro at 100000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 32.4570312500000 0.000000000000000E+000
- REMD writing rst time= 0.000000000000000E+000
- REMD writing traj time= 3.906250000000000E-003
+ REMD gather times= 40.7031250000000 0.000000000000000E+000
+ REMD writing rst time= 3.906250000000000E-003
+ REMD writing traj time= 0.000000000000000E+000
NREP 16
-ACC 1 250.00000 0.00000 1
-ACC 2 260.00000 1.00000 1
+ACC 1 250.00000 1.00000 1
+ACC 2 260.00000 0.00000 1
ACC 3 270.00000 1.00000 1
ACC 4 280.00000 1.00000 1
ACC 5 290.00000 1.00000 1
-ACC 6 300.00000 0.00000 1
-ACC 7 310.00000 1.00000 1
+ACC 6 300.00000 1.00000 1
+ACC 7 310.00000 0.00000 1
ACC 8 320.00000 1.00000 1
ACC 9 330.00000 1.00000 1
ACC 10 340.00000 0.00000 1
ACC 11 350.00000 1.00000 1
ACC 12 360.00000 1.00000 1
ACC 13 370.00000 1.00000 1
-ACC 14 380.00000 0.00000 1
+ACC 14 380.00000 1.00000 1
ACC 15 390.00000 1.00000 1
REMD scatter time= 0.000000000000000E+000
REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 5.51742436744485
- 14.0265976214885 split increased to 2 itime 100969
+ acceleration/energy drift too large 4.35448070508831
+ 13.8446433589411 split increased to 2 itime 100323
itsplit 1
- acceleration/energy drift too large 8.07631683553030
- 27.4157645268179 split increased to 2 itime 101211
- itsplit 1
- acceleration/energy drift too large 7.53875747318140
- 25.3328732954551 split increased to 2 itime 108352
- itsplit 1
-Velocities reset to random values, time 21999.80
- acceleration/energy drift too large 9.39240083505564
- 39.4249240389017 split increased to 2 itime 110190
+ acceleration/energy drift too large 9.10122520864291
+ 38.0141323325797 split increased to 2 itime 103166
itsplit 1
- acceleration/energy drift too large 4.76024818679591
- 30.4924635834113 split increased to 2 itime 110638
+ acceleration/energy drift too large 7.33321494991676
+ 17.4365905621355 split increased to 2 itime 103334
itsplit 1
- acceleration/energy drift too large 1.31288243287358
- 10.8527620928399 split increased to 2 itime 110639
+ acceleration/energy drift too large 4.03416178930275
+ 14.7407403165802 split increased to 2 itime 104813
itsplit 1
- acceleration/energy drift too large 6.81636183959539
- 33.1184415378304 split increased to 2 itime 112145
+ acceleration/energy drift too large 5.07776178961767
+ 24.5089488434180 split increased to 2 itime 107051
itsplit 1
- acceleration/energy drift too large 3.98665078701864
- 21.8401031536524 split increased to 2 itime 112531
+ acceleration/energy drift too large 5.83433628505584
+ 11.0882735379548 split increased to 2 itime 107519
itsplit 1
- acceleration/energy drift too large 2.30301545304386
- 13.1975597100287 split increased to 2 itime 112566
+ acceleration/energy drift too large 2.58209681131064
+ 16.9909667876258 split increased to 2 itime 107763
itsplit 1
- acceleration/energy drift too large 5.77055810298729
- 20.6058094052798 split increased to 2 itime 115260
+ acceleration/energy drift too large 4.83068352453098
+ 17.4988377320686 split increased to 2 itime 107878
itsplit 1
- acceleration/energy drift too large 4.92220818641102
- 11.3454156652110 split increased to 2 itime 115909
+ acceleration/energy drift too large 4.32781910400729
+ 19.6525957626685 split increased to 2 itime 108393
itsplit 1
- acceleration/energy drift too large 2.14761338786285
- 11.1477590847579 split increased to 2 itime 117210
+ acceleration/energy drift too large 4.92725474578742
+ 27.3936140459521 split increased to 2 itime 108690
itsplit 1
- acceleration/energy drift too large 5.23498360872986
- 27.0934886945752 split increased to 2 itime 119472
+ acceleration/energy drift too large 6.04694829592555
+ 14.0820008455919 split increased to 2 itime 108824
itsplit 1
- acceleration/energy drift too large 4.11585782105189
- 11.4508735593269 split increased to 2 itime 119533
+Velocities reset to random values, time 21999.80
+ acceleration/energy drift too large 2.31334984161789
+ 11.0510007802944 split increased to 2 itime 113675
itsplit 1
-Velocities reset to random values, time 23999.80
- acceleration/energy drift too large 2.43798570374047
- 11.1861669030335 split increased to 2 itime 120113
+ acceleration/energy drift too large 9.08574561915987
+ 36.2334279426986 split increased to 2 itime 113795
itsplit 1
- acceleration/energy drift too large 11.7521488319802
- 61.7701860413211 split increased to 2 itime 123112
+ acceleration/energy drift too large 2.85772593867820
+ 20.5985997257337 split increased to 2 itime 115172
itsplit 1
- acceleration/energy drift too large 2.53897053368932
- 11.3666539546643 split increased to 2 itime 125045
+ acceleration/energy drift too large 5.63586016608634
+ 13.3027742623851 split increased to 2 itime 115983
itsplit 1
- acceleration/energy drift too large 12.8387105719924
- 54.5120891554408 split increased to 2 itime 125202
+ acceleration/energy drift too large 6.20811917219129
+ 16.7692644070182 split increased to 2 itime 117311
itsplit 1
- acceleration/energy drift too large 10.9350899589753
- 56.2610284056609 split increased to 2 itime 125646
+ acceleration/energy drift too large 7.62107699311359
+ 30.3679961139096 split increased to 2 itime 117654
itsplit 1
- acceleration/energy drift too large 13.8303247530903
- 85.2058047271786 split increased to 2 itime 125879
+Velocities reset to random values, time 23999.80
+ acceleration/energy drift too large 3.13359422976402
+ 16.7704903423790 split increased to 2 itime 122162
itsplit 1
- acceleration/energy drift too large 4.20972635890044
- 11.7844987862646 split increased to 2 itime 126284
+ acceleration/energy drift too large 5.39673707607405
+ 12.4650082655816 split increased to 2 itime 125438
itsplit 1
- acceleration/energy drift too large 5.62409852785931
- 14.3089065432378 split increased to 2 itime 126902
+ acceleration/energy drift too large 5.68067325824305
+ 19.5477835104925 split increased to 2 itime 125841
itsplit 1
- acceleration/energy drift too large 11.6497884218717
- 61.8300321802005 split increased to 2 itime 127489
+ acceleration/energy drift too large 5.28867228957150
+ 12.8872218727007 split increased to 2 itime 126987
itsplit 1
- acceleration/energy drift too large 3.52041662786424
- 26.5497349239630 split increased to 2 itime 128825
+ acceleration/energy drift too large 5.23392675566275
+ 15.8307586052208 split increased to 2 itime 127635
itsplit 1
- acceleration/energy drift too large 9.91725669960011
- 48.0420317005275 split increased to 2 itime 129459
+ acceleration/energy drift too large 4.22226038060222
+ 11.4869896794526 split increased to 2 itime 128683
itsplit 1
Velocities reset to random values, time 25999.80
- acceleration/energy drift too large 6.33840263238366
- 19.8955965216626 split increased to 2 itime 131496
+ acceleration/energy drift too large 10.2897108060629
+ 47.2655773405908 split increased to 2 itime 131897
itsplit 1
- acceleration/energy drift too large 6.89779881849586
- 24.6361446985916 split increased to 2 itime 131719
+ acceleration/energy drift too large 4.63961305374192
+ 19.7877922019811 split increased to 2 itime 132475
itsplit 1
- acceleration/energy drift too large 8.64476537657602
- 38.5151251917489 split increased to 2 itime 135543
+ acceleration/energy drift too large 3.79191474848373
+ 11.2296364330073 split increased to 2 itime 133469
itsplit 1
- acceleration/energy drift too large 2.73210798461626
- 15.9427674606313 split increased to 2 itime 136208
+ acceleration/energy drift too large 5.55808496076198
+ 13.0888388315887 split increased to 2 itime 134208
itsplit 1
- acceleration/energy drift too large 3.99145270898172
- 23.1504394395399 split increased to 2 itime 137549
+ acceleration/energy drift too large 3.40324385673822
+ 10.9946173158140 split increased to 2 itime 135224
itsplit 1
- acceleration/energy drift too large 2.97411118249101
- 13.3313779276461 split increased to 2 itime 137550
+ acceleration/energy drift too large 2.40033467565452
+ 14.5839349222692 split increased to 2 itime 135587
itsplit 1
- acceleration/energy drift too large 7.34453895024246
- 23.0423555004243 split increased to 2 itime 138034
- itsplit 1
- acceleration/energy drift too large 4.13591996818445
- 13.7228637318129 split increased to 2 itime 139196
+ acceleration/energy drift too large 2.20051529212891
+ 12.1343147458011 split increased to 2 itime 137113
itsplit 1
Velocities reset to random values, time 27999.80
- acceleration/energy drift too large 5.27170590488248
- 15.8994715154301 split increased to 2 itime 141895
+ acceleration/energy drift too large 1.51243590564560
+ 10.4125643397107 split increased to 2 itime 141421
itsplit 1
- acceleration/energy drift too large 2.29549552314348
- 11.3527523827965 split increased to 2 itime 142335
+ acceleration/energy drift too large 2.24851777080701
+ 12.8862673504551 split increased to 2 itime 142525
itsplit 1
- acceleration/energy drift too large 2.80950075819075
- 17.5454765181910 split increased to 2 itime 146511
+ acceleration/energy drift too large 1.86181300710243
+ 11.9943618375029 split increased to 2 itime 143745
itsplit 1
- acceleration/energy drift too large 7.66979890644345
- 28.1269913668128 split increased to 2 itime 146571
+ acceleration/energy drift too large 3.34931468736467
+ 13.1747705305961 split increased to 2 itime 144553
itsplit 1
- acceleration/energy drift too large 1.83750482976047
- 11.2927046869647 split increased to 2 itime 147455
+ acceleration/energy drift too large 5.45961170533437
+ 16.3411696913215 split increased to 2 itime 145648
itsplit 1
- acceleration/energy drift too large 4.49097553734581
- 13.5025464597718 split increased to 2 itime 148360
+ acceleration/energy drift too large 5.03682432677429
+ 13.1728740518157 split increased to 2 itime 147537
itsplit 1
- acceleration/energy drift too large 12.7753819538135
- 67.2597458490523 split increased to 2 itime 149346
+ acceleration/energy drift too large 2.94172430796647
+ 10.6658719607246 split increased to 2 itime 148657
itsplit 1
Velocities reset to random values, time 29999.80
- acceleration/energy drift too large 3.13918770825019
- 12.9183895635247 split increased to 2 itime 150047
+ acceleration/energy drift too large 3.36012645724516
+ 18.2415358505736 split increased to 2 itime 150136
itsplit 1
- acceleration/energy drift too large 7.70495773801530
- 27.4202024361163 split increased to 2 itime 150578
+ acceleration/energy drift too large 4.50367798267562
+ 10.9513549551997 split increased to 2 itime 152854
itsplit 1
- acceleration/energy drift too large 4.50509674993982
- 12.6869728568690 split increased to 2 itime 151694
+ acceleration/energy drift too large 6.64432852014870
+ 23.2809343576262 split increased to 2 itime 154938
itsplit 1
- acceleration/energy drift too large 2.46122634502520
- 10.4875528280421 split increased to 2 itime 153958
+ acceleration/energy drift too large 9.68701714425696
+ 27.7131509314324 split increased to 2 itime 157526
itsplit 1
- acceleration/energy drift too large 3.30042271841076
- 11.7664919359739 split increased to 2 itime 154278
+ acceleration/energy drift too large 5.02180381636210
+ 15.2005372941025 split increased to 2 itime 158091
itsplit 1
- acceleration/energy drift too large 2.91433380110864
- 17.4391177991060 split increased to 2 itime 156449
+ acceleration/energy drift too large 9.98212667355771
+ 40.9197199265875 split increased to 2 itime 158606
itsplit 1
- acceleration/energy drift too large 2.65241760471706
- 15.3892689211646 split increased to 2 itime 157551
+ acceleration/energy drift too large 5.92400546526831
+ 10.8486740550381 split increased to 2 itime 158607
itsplit 1
Velocities reset to random values, time 31999.80
- acceleration/energy drift too large 4.86481547725471
- 13.0337216522816 split increased to 2 itime 161291
+ acceleration/energy drift too large 6.63677126385129
+ 13.4519710405256 split increased to 2 itime 161183
itsplit 1
- acceleration/energy drift too large 4.67711534592990
- 19.5555895474847 split increased to 2 itime 161406
+ acceleration/energy drift too large 9.02309977671454
+ 43.4743141599911 split increased to 2 itime 162685
itsplit 1
- acceleration/energy drift too large 7.24277639005596
- 23.6959197447202 split increased to 2 itime 163001
+ acceleration/energy drift too large 10.7477627647307
+ 56.5206090523827 split increased to 2 itime 164614
itsplit 1
- acceleration/energy drift too large 7.16437989183504
- 32.4539908463105 split increased to 2 itime 165574
+ acceleration/energy drift too large 4.37339566286833
+ 11.9320848031680 split increased to 2 itime 164825
itsplit 1
- acceleration/energy drift too large 8.94832543499673
- 33.7422110303631 split increased to 2 itime 167127
+ acceleration/energy drift too large 6.31903118179166
+ 27.2735446963399 split increased to 2 itime 166474
itsplit 1
- acceleration/energy drift too large 2.40318050495548
- 12.9399160373974 split increased to 2 itime 168087
+ acceleration/energy drift too large 9.56855466219324
+ 41.3133616825764 split increased to 2 itime 166745
itsplit 1
- acceleration/energy drift too large 5.08619308531763
- 19.7772999197684 split increased to 2 itime 168216
+ acceleration/energy drift too large 3.29687662847975
+ 10.3954562349500 split increased to 2 itime 167046
itsplit 1
- acceleration/energy drift too large 8.28851386545201
- 31.6841420255888 split increased to 2 itime 168330
+ acceleration/energy drift too large 9.29598597418801
+ 41.1802372258857 split increased to 2 itime 167521
itsplit 1
- acceleration/energy drift too large 5.17352821027988
- 17.4815236076176 split increased to 2 itime 168639
+ acceleration/energy drift too large 2.42206525721097
+ 13.4448009896313 split increased to 2 itime 168510
itsplit 1
- acceleration/energy drift too large 2.66900352352891
- 15.7196773953528 split increased to 2 itime 169647
+ acceleration/energy drift too large 2.55136709205292
+ 15.5962530869405 split increased to 2 itime 169889
itsplit 1
Velocities reset to random values, time 33999.80
- acceleration/energy drift too large 2.84582404833511
- 13.3758961875279 split increased to 2 itime 171732
+ acceleration/energy drift too large 8.83122990483117
+ 22.6521215967247 split increased to 2 itime 170303
itsplit 1
- acceleration/energy drift too large 4.37087753838403
- 11.9358322781346 split increased to 2 itime 173108
+ acceleration/energy drift too large 9.21009913786138
+ 37.6561438646460 split increased to 2 itime 170521
itsplit 1
- acceleration/energy drift too large 7.26616424956899
- 26.7344874442642 split increased to 2 itime 174105
+ acceleration/energy drift too large 3.48739909254491
+ 10.1034471242695 split increased to 2 itime 171396
itsplit 1
- acceleration/energy drift too large 2.91326123770430
- 17.0570957437834 split increased to 2 itime 174759
+ acceleration/energy drift too large 6.98696370027955
+ 23.8374696957620 split increased to 2 itime 171515
itsplit 1
- acceleration/energy drift too large 4.94938768193702
- 15.8387782647101 split increased to 2 itime 176274
+ acceleration/energy drift too large 3.35531610328897
+ 10.9981633001393 split increased to 2 itime 171580
itsplit 1
- acceleration/energy drift too large 2.40495213231953
- 11.3032965130233 split increased to 2 itime 177958
+ acceleration/energy drift too large 8.07241169933481
+ 39.9957178029709 split increased to 2 itime 172646
itsplit 1
- acceleration/energy drift too large 5.47005295188550
- 18.8364891836282 split increased to 2 itime 178041
+ acceleration/energy drift too large 3.74425066749434
+ 10.7421718827410 split increased to 2 itime 173898
itsplit 1
- acceleration/energy drift too large 4.32677806734398
- 14.0369541480040 split increased to 2 itime 179811
+ acceleration/energy drift too large 4.09077031120363
+ 20.4138189459720 split increased to 2 itime 174085
itsplit 1
-Velocities reset to random values, time 35999.80
- acceleration/energy drift too large 2.13713649414502
- 11.4238786773806 split increased to 2 itime 182294
+ acceleration/energy drift too large 6.26747919763318
+ 19.3655660658169 split increased to 2 itime 174385
+ itsplit 1
+ acceleration/energy drift too large 5.12079076084499
+ 19.8211658321753 split increased to 2 itime 174408
itsplit 1
- acceleration/energy drift too large 3.63311417481270
- 10.9196211161612 split increased to 2 itime 182445
+ acceleration/energy drift too large 11.6070059234368
+ 56.7944264555530 split increased to 2 itime 174542
itsplit 1
- acceleration/energy drift too large 5.22807673884063
- 12.6896019176836 split increased to 2 itime 183672
+ acceleration/energy drift too large 5.64271108431878
+ 16.1575599927218 split increased to 2 itime 177089
itsplit 1
- acceleration/energy drift too large 3.97075634982625
- 10.8151470781805 split increased to 2 itime 184124
+ acceleration/energy drift too large 5.92551738900429
+ 26.4343943067627 split increased to 2 itime 177561
itsplit 1
- acceleration/energy drift too large 1.66428664666589
- 10.6981642972458 split increased to 2 itime 184576
+ acceleration/energy drift too large 4.99199180829665
+ 13.7084327060582 split increased to 2 itime 177843
itsplit 1
- acceleration/energy drift too large 3.19698191856337
- 15.6513406019465 split increased to 2 itime 187296
+ acceleration/energy drift too large 4.32576336099416
+ 12.1621048922766 split increased to 2 itime 178120
itsplit 1
- acceleration/energy drift too large 3.50528451775033
- 23.6957909486519 split increased to 2 itime 188215
+ acceleration/energy drift too large 4.94170430783359
+ 11.9934943440670 split increased to 2 itime 178559
itsplit 1
- acceleration/energy drift too large 7.70753601951289
- 25.5040547735754 split increased to 2 itime 188485
+ acceleration/energy drift too large 4.63063674500056
+ 15.2037357814957 split increased to 2 itime 179629
+ itsplit 1
+Velocities reset to random values, time 35999.80
+ acceleration/energy drift too large 2.40543951143176
+ 13.6095987658594 split increased to 2 itime 183487
+ itsplit 1
+ acceleration/energy drift too large 7.59166874978070
+ 16.9312036859759 split increased to 2 itime 185431
+ itsplit 1
+ acceleration/energy drift too large 4.73780332337024
+ 11.9427673447535 split increased to 2 itime 189811
itsplit 1
Velocities reset to random values, time 37999.80
- acceleration/energy drift too large 7.30201529134417
- 29.3612786650354 split increased to 2 itime 190097
+ acceleration/energy drift too large 4.51385244779712
+ 13.3188888785989 split increased to 2 itime 190291
+ itsplit 1
+ acceleration/energy drift too large 5.43517833888924
+ 13.1128761945997 split increased to 2 itime 190475
itsplit 1
- acceleration/energy drift too large 2.97663403371506
- 10.5329409432660 split increased to 2 itime 192229
+ acceleration/energy drift too large 6.61543911793257
+ 18.7309363335260 split increased to 2 itime 191542
itsplit 1
- acceleration/energy drift too large 6.00102112501053
- 17.2545438006455 split increased to 2 itime 192358
+ acceleration/energy drift too large 10.2079615199183
+ 55.0917389987583 split increased to 2 itime 191713
itsplit 1
- acceleration/energy drift too large 7.11490690952608
- 23.9903146343609 split increased to 2 itime 193013
+ acceleration/energy drift too large 9.54919131748580
+ 53.1830142226373 split increased to 2 itime 193417
itsplit 1
- acceleration/energy drift too large 3.63050744544843
- 10.5030943717994 split increased to 2 itime 196768
+ acceleration/energy drift too large 5.22498373776129
+ 13.9161593831138 split increased to 2 itime 193823
itsplit 1
- acceleration/energy drift too large 4.38219369716297
- 12.4620798509392 split increased to 2 itime 198899
+ acceleration/energy drift too large 4.90175789355778
+ 17.9210202820440 split increased to 2 itime 195121
+ itsplit 1
+ acceleration/energy drift too large 5.02477140817033
+ 15.0376588234653 split increased to 2 itime 195906
+ itsplit 1
+ acceleration/energy drift too large 7.29923138334724
+ 23.1812204832951 split increased to 2 itime 195965
+ itsplit 1
+ acceleration/energy drift too large 5.71234101740440
+ 28.1120096098226 split increased to 2 itime 196182
itsplit 1
Velocities reset to random values, time 39999.80
REMD synchro at 200000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 65.0585937500000 0.000000000000000E+000
- REMD writing rst time= 0.000000000000000E+000
- REMD writing traj time= 3.906250000000000E-003
+ REMD gather times= 81.4960937500000 0.000000000000000E+000
+ REMD writing rst time= 3.906250000000000E-003
+ REMD writing traj time= 0.000000000000000E+000
NREP 16
ACC 1 250.00000 0.50000 2
-ACC 2 260.00000 1.00000 2
-ACC 3 270.00000 0.50000 2
-ACC 4 280.00000 1.00000 2
+ACC 2 260.00000 0.00000 2
+ACC 3 270.00000 1.00000 2
+ACC 4 280.00000 0.50000 2
ACC 5 290.00000 1.00000 2
-ACC 6 300.00000 0.50000 2
-ACC 7 310.00000 1.00000 2
-ACC 8 320.00000 0.50000 2
+ACC 6 300.00000 1.00000 2
+ACC 7 310.00000 0.00000 2
+ACC 8 320.00000 1.00000 2
ACC 9 330.00000 1.00000 2
ACC 10 340.00000 0.50000 2
ACC 11 350.00000 0.50000 2
ACC 12 360.00000 1.00000 2
ACC 13 370.00000 1.00000 2
-ACC 14 380.00000 0.50000 2
+ACC 14 380.00000 1.00000 2
ACC 15 390.00000 1.00000 2
- REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 4.12005598746506
- 26.8265104044733 split increased to 2 itime 201171
+ REMD scatter time= 3.906250000000000E-003
+ REMD exchange time= 7.812500000000000E-003
+ acceleration/energy drift too large 3.64029108679463
+ 11.5808204189943 split increased to 2 itime 200127
itsplit 1
- acceleration/energy drift too large 5.06408092657911
- 11.7619391109019 split increased to 2 itime 205881
+ acceleration/energy drift too large 7.84893539743313
+ 20.2866410836206 split increased to 2 itime 200971
itsplit 1
- acceleration/energy drift too large 3.95228704486008
- 10.7175271232026 split increased to 2 itime 205946
+ acceleration/energy drift too large 8.61828598982526
+ 31.2234501134643 split increased to 2 itime 200991
itsplit 1
- acceleration/energy drift too large 4.94083300177811
- 12.3070448407487 split increased to 2 itime 205981
+ acceleration/energy drift too large 3.90898684769792
+ 12.8182943612382 split increased to 2 itime 201106
itsplit 1
- acceleration/energy drift too large 14.0838944511248
- 77.7514175852990 split increased to 2 itime 207654
+ acceleration/energy drift too large 4.99620821795401
+ 31.4141118797693 split increased to 2 itime 202501
itsplit 1
- acceleration/energy drift too large 3.54383555671123
- 19.7659337009395 split increased to 4 itime 207654
- itsplit 2
- acceleration/energy drift too large 3.02034284515368
- 11.4558591427247 split increased to 2 itime 209866
+ acceleration/energy drift too large 4.11614735585937
+ 12.1594147833547 split increased to 2 itime 203548
itsplit 1
- acceleration/energy drift too large 4.17936302127454
- 20.4803767434982 split increased to 2 itime 209883
+ acceleration/energy drift too large 8.21142321791518
+ 27.3137190575929 split increased to 2 itime 203955
itsplit 1
-Velocities reset to random values, time 41999.80
- acceleration/energy drift too large 5.38994510406471
- 31.4907267266831 split increased to 2 itime 210052
+ acceleration/energy drift too large 4.08842412054590
+ 11.4467897768593 split increased to 2 itime 204624
itsplit 1
- acceleration/energy drift too large 11.1927643619579
- 51.3158581610119 split increased to 2 itime 211225
+ acceleration/energy drift too large 2.91511126819742
+ 10.4004748089627 split increased to 2 itime 204625
itsplit 1
- acceleration/energy drift too large 5.95818691696201
- 11.9755156929437 split increased to 2 itime 212943
+ acceleration/energy drift too large 7.97609970177051
+ 17.0341262811947 split increased to 2 itime 206420
itsplit 1
- acceleration/energy drift too large 5.85919212752276
- 15.1525322983036 split increased to 2 itime 215707
+ acceleration/energy drift too large 3.93332263000041
+ 10.8824839165261 split increased to 2 itime 206962
itsplit 1
- acceleration/energy drift too large 4.48717380378777
- 12.3899819649136 split increased to 2 itime 215726
+ acceleration/energy drift too large 2.11294819353670
+ 14.7854318315743 split increased to 2 itime 207256
itsplit 1
- acceleration/energy drift too large 4.41952874000882
- 15.9157891887456 split increased to 2 itime 218908
+ acceleration/energy drift too large 4.44706169021173
+ 14.5530567176186 split increased to 2 itime 208568
itsplit 1
- acceleration/energy drift too large 6.46389728068579
- 35.5873569666876 split increased to 2 itime 219156
+ acceleration/energy drift too large 5.01020364970164
+ 12.6036747656131 split increased to 2 itime 208643
itsplit 1
-Velocities reset to random values, time 43999.80
- acceleration/energy drift too large 4.91039207226218
- 15.4373257404077 split increased to 2 itime 220001
+Velocities reset to random values, time 41999.80
+ acceleration/energy drift too large 5.78150176725295
+ 33.3137796486345 split increased to 2 itime 212347
itsplit 1
- acceleration/energy drift too large 12.2732224302885
- 56.8079617618095 split increased to 2 itime 220627
+ acceleration/energy drift too large 2.48833566613545
+ 10.2949905328240 split increased to 2 itime 214105
itsplit 1
- acceleration/energy drift too large 4.81271719752747
- 11.3228740008231 split increased to 2 itime 220912
+ acceleration/energy drift too large 3.64618927235946
+ 18.7503821421103 split increased to 2 itime 214302
itsplit 1
- acceleration/energy drift too large 3.87447878159296
- 10.8293451507620 split increased to 2 itime 221383
+ acceleration/energy drift too large 3.07400599095336
+ 11.3383323166579 split increased to 2 itime 215814
itsplit 1
- acceleration/energy drift too large 5.26992023854901
- 13.6633658720417 split increased to 2 itime 223028
+ acceleration/energy drift too large 4.42973008487847
+ 20.3411262897984 split increased to 2 itime 216252
itsplit 1
- acceleration/energy drift too large 4.55885166032367
- 15.7150206068581 split increased to 2 itime 228478
+ acceleration/energy drift too large 5.62920671173806
+ 32.2983009905205 split increased to 2 itime 218037
itsplit 1
-Velocities reset to random values, time 45999.80
- acceleration/energy drift too large 4.68899252783469
- 11.4969623789216 split increased to 2 itime 230031
+ acceleration/energy drift too large 5.45527892756425
+ 21.9773808882954 split increased to 2 itime 219345
itsplit 1
- acceleration/energy drift too large 3.71894935396341
- 13.8702896011761 split increased to 2 itime 230039
+ acceleration/energy drift too large 4.15721010187859
+ 20.5697747905902 split increased to 2 itime 219966
itsplit 1
- acceleration/energy drift too large 5.81066197577871
- 14.7086713645803 split increased to 2 itime 230131
+ acceleration/energy drift too large 5.33603019769579
+ 30.3679010229435 split increased to 2 itime 219983
itsplit 1
- acceleration/energy drift too large 12.9775047589173
- 67.3033797903276 split increased to 2 itime 231674
+Velocities reset to random values, time 43999.80
+ acceleration/energy drift too large 7.86255698363788
+ 24.2910471349705 split increased to 2 itime 221224
itsplit 1
- acceleration/energy drift too large 2.77913922606047
- 12.5678197461230 split increased to 4 itime 231674
- itsplit 2
- acceleration/energy drift too large 3.20590133189049
- 10.5492959576413 split increased to 2 itime 233247
+ acceleration/energy drift too large 4.63244311550015
+ 18.0541134191384 split increased to 2 itime 221403
itsplit 1
- acceleration/energy drift too large 3.05610414398999
- 12.0900579947977 split increased to 2 itime 233562
+ acceleration/energy drift too large 13.1527124335790
+ 77.1748219974411 split increased to 2 itime 222333
itsplit 1
- acceleration/energy drift too large 2.88486602699542
- 19.6125556144999 split increased to 2 itime 234697
+ acceleration/energy drift too large 2.56016933409559
+ 17.6552737911425 split increased to 2 itime 222334
itsplit 1
- acceleration/energy drift too large 3.01148604088687
- 10.6935522342608 split increased to 2 itime 235099
+ acceleration/energy drift too large 7.40887283834941
+ 30.7362315013208 split increased to 2 itime 222409
itsplit 1
- acceleration/energy drift too large 2.10638081681988
- 10.8366283051455 split increased to 2 itime 237838
+ acceleration/energy drift too large 3.83870075950039
+ 13.5024094254713 split increased to 2 itime 222526
itsplit 1
- acceleration/energy drift too large 4.92952713491473
- 11.6684361091211 split increased to 2 itime 238585
+ acceleration/energy drift too large 2.97288409075136
+ 12.0415711331916 split increased to 2 itime 223341
itsplit 1
-Velocities reset to random values, time 47999.80
- acceleration/energy drift too large 7.21492533794259
- 12.8010011198368 split increased to 2 itime 241924
+ acceleration/energy drift too large 4.83229449875740
+ 21.6789948138393 split increased to 2 itime 223849
itsplit 1
- acceleration/energy drift too large 4.95738912688542
- 14.9427641999267 split increased to 2 itime 242964
+ acceleration/energy drift too large 6.29460704954891
+ 45.4627654416730 split increased to 2 itime 224172
itsplit 1
- acceleration/energy drift too large 5.65263715961087
- 15.2728506186217 split increased to 2 itime 243369
+ acceleration/energy drift too large 4.41765622249369
+ 11.2907156327815 split increased to 2 itime 225102
itsplit 1
- acceleration/energy drift too large 5.60223112758211
- 14.2774720664666 split increased to 2 itime 243506
+ acceleration/energy drift too large 4.17195687990816
+ 16.4423114033335 split increased to 2 itime 225108
itsplit 1
- acceleration/energy drift too large 4.75963628894287
- 10.9806253137581 split increased to 2 itime 243638
+ acceleration/energy drift too large 4.97740142086614
+ 10.4943627686938 split increased to 2 itime 228677
itsplit 1
- acceleration/energy drift too large 6.15649019245663
- 14.7533307317650 split increased to 2 itime 243787
+Velocities reset to random values, time 45999.80
+ acceleration/energy drift too large 4.27127350688728
+ 16.0133778665926 split increased to 2 itime 230839
itsplit 1
- acceleration/energy drift too large 5.12660551264934
- 12.1952853109267 split increased to 2 itime 243944
+ acceleration/energy drift too large 3.84238305207740
+ 15.3160425709751 split increased to 2 itime 233269
itsplit 1
- acceleration/energy drift too large 6.11038329995401
- 24.7509080548857 split increased to 2 itime 244108
+ acceleration/energy drift too large 5.96490424978640
+ 35.8849072535118 split increased to 2 itime 233417
itsplit 1
- acceleration/energy drift too large 8.00892300283006
- 20.0510330946193 split increased to 2 itime 244783
+ acceleration/energy drift too large 0.969965490275774
+ 15.0758079154002 split increased to 2 itime 233418
itsplit 1
- acceleration/energy drift too large 3.09642709300335
- 12.1087234656764 split increased to 2 itime 245969
+ acceleration/energy drift too large 7.37427950936088
+ 53.9441579641732 split increased to 2 itime 233886
itsplit 1
- acceleration/energy drift too large 5.31086637503857
- 16.2041290485040 split increased to 2 itime 246191
+ acceleration/energy drift too large 9.41795446120100
+ 46.6923483267551 split increased to 2 itime 234145
itsplit 1
- acceleration/energy drift too large 2.78714651707087
- 16.0413343086024 split increased to 2 itime 246386
+ acceleration/energy drift too large 5.72509711572049
+ 31.9842401234587 split increased to 2 itime 234299
itsplit 1
- acceleration/energy drift too large 8.58558639017791
- 33.1799985845112 split increased to 2 itime 247106
+ acceleration/energy drift too large 5.04462270994681
+ 11.9549114696995 split increased to 2 itime 236561
itsplit 1
- acceleration/energy drift too large 3.68699369121782
- 11.4027637890993 split increased to 2 itime 247395
+ acceleration/energy drift too large 4.77591180817061
+ 15.8503289913584 split increased to 2 itime 236970
itsplit 1
- acceleration/energy drift too large 3.15046881309695
- 17.2306592765123 split increased to 2 itime 248678
+ acceleration/energy drift too large 9.56031823597878
+ 38.5355027802804 split increased to 2 itime 237148
itsplit 1
-Velocities reset to random values, time 49999.80
- acceleration/energy drift too large 5.46590387894613
- 13.3773268869361 split increased to 2 itime 250995
+ acceleration/energy drift too large 2.55298889382046
+ 10.1810238981961 split increased to 4 itime 237148
itsplit 1
- acceleration/energy drift too large 3.51492400773143
- 11.4473208028156 split increased to 2 itime 252706
+ acceleration/energy drift too large 5.07272249032121
+ 16.1665416130016 split increased to 2 itime 237638
itsplit 1
- acceleration/energy drift too large 3.23179322206460
- 10.0465226493719 split increased to 2 itime 253636
+ acceleration/energy drift too large 5.27519412971984
+ 24.3386506952302 split increased to 2 itime 237641
itsplit 1
- acceleration/energy drift too large 3.18533944039498
- 10.8326218717861 split increased to 2 itime 254852
+ acceleration/energy drift too large 3.76916747155580
+ 19.3249777140934 split increased to 2 itime 238007
itsplit 1
- acceleration/energy drift too large 6.30916306134863
- 19.2201047617479 split increased to 2 itime 255716
+ acceleration/energy drift too large 9.50976115289862
+ 35.9477138344235 split increased to 2 itime 238272
itsplit 1
- acceleration/energy drift too large 6.22279756457394
- 18.8015833890690 split increased to 2 itime 258223
+ acceleration/energy drift too large 8.52032923205173
+ 36.0891822567616 split increased to 2 itime 238339
itsplit 1
- acceleration/energy drift too large 6.25892603292813
- 16.6726352776889 split increased to 2 itime 259428
+ acceleration/energy drift too large 4.37531723947444
+ 28.2163048638802 split increased to 2 itime 238549
itsplit 1
- acceleration/energy drift too large 2.50474128600706
- 13.2263060719779 split increased to 2 itime 259802
+ acceleration/energy drift too large 5.83050845840029
+ 62.0343502726120 split increased to 2 itime 238652
itsplit 1
-Velocities reset to random values, time 51999.80
- acceleration/energy drift too large 9.69887436108203
- 42.7700032444463 split increased to 2 itime 261389
+ acceleration/energy drift too large 2.94147085871858
+ 18.3006940499288 split increased to 2 itime 238653
itsplit 1
- acceleration/energy drift too large 4.92657874789024
- 15.2015454686545 split increased to 2 itime 266982
- itsplit 1
-Velocities reset to random values, time 53999.80
- acceleration/energy drift too large 4.28290698513165
- 11.2626559291463 split increased to 2 itime 270216
+ acceleration/energy drift too large 5.10273834765773
+ 13.3326960926028 split increased to 2 itime 238936
itsplit 1
- acceleration/energy drift too large 3.17009098471273
- 18.2859008425981 split increased to 2 itime 270908
+ acceleration/energy drift too large 4.23402871458675
+ 18.9050545180794 split increased to 2 itime 239782
itsplit 1
- acceleration/energy drift too large 2.88191663965288
- 12.7129664832895 split increased to 2 itime 271940
+Velocities reset to random values, time 47999.80
+ acceleration/energy drift too large 3.23999938998729
+ 12.9551205421106 split increased to 2 itime 240340
itsplit 1
- acceleration/energy drift too large 8.97953911000665
- 26.0449926061857 split increased to 2 itime 272989
+ acceleration/energy drift too large 11.2944817033609
+ 62.9989006860680 split increased to 2 itime 240342
itsplit 1
- acceleration/energy drift too large 5.75003682092487
- 11.1873394140884 split increased to 2 itime 273490
+ acceleration/energy drift too large 3.60501336178358
+ 11.5827695216757 split increased to 2 itime 240549
itsplit 1
- acceleration/energy drift too large 3.05900964176420
- 17.9989105583477 split increased to 2 itime 275687
+ acceleration/energy drift too large 8.24479107287119
+ 24.3249867142891 split increased to 2 itime 240788
itsplit 1
- acceleration/energy drift too large 5.26869415309939
- 26.6464975094380 split increased to 2 itime 276139
+ acceleration/energy drift too large 5.78210270383508
+ 16.4390937845794 split increased to 2 itime 241766
itsplit 1
- acceleration/energy drift too large 5.52160444042243
- 28.5629386407219 split increased to 2 itime 276533
+ acceleration/energy drift too large 5.38095702852528
+ 30.8541250240317 split increased to 2 itime 242631
itsplit 1
- acceleration/energy drift too large 3.89834398437638
- 20.7807709706583 split increased to 2 itime 276777
+ acceleration/energy drift too large 3.17985646556209
+ 10.6175984679630 split increased to 2 itime 242632
itsplit 1
- acceleration/energy drift too large 2.35929222026222
- 17.6330220639635 split increased to 2 itime 277586
+ acceleration/energy drift too large 5.61402658474446
+ 29.2120104128018 split increased to 2 itime 242875
itsplit 1
- acceleration/energy drift too large 5.92549302543821
- 19.5824021700537 split increased to 2 itime 278607
+ acceleration/energy drift too large 4.43724922702687
+ 22.4636384195783 split increased to 2 itime 246160
itsplit 1
- acceleration/energy drift too large 4.71335792340797
- 13.1077127549953 split increased to 2 itime 279037
+ acceleration/energy drift too large 8.81223496649992
+ 108.925008665967 split increased to 2 itime 246191
itsplit 1
- acceleration/energy drift too large 4.50657794062307
- 10.4004743921879 split increased to 2 itime 279999
+ acceleration/energy drift too large 7.98152961526920
+ 30.4264224879624 split increased to 2 itime 247522
itsplit 1
-Velocities reset to random values, time 55999.80
- acceleration/energy drift too large 6.31300669977864
- 20.4693652293443 split increased to 2 itime 281861
+Velocities reset to random values, time 49999.80
+ acceleration/energy drift too large 5.05546510683783
+ 15.9312413868997 split increased to 2 itime 250021
itsplit 1
- acceleration/energy drift too large 4.42716634402676
- 18.9502705818514 split increased to 2 itime 283971
+ acceleration/energy drift too large 4.52138789692115
+ 19.8559420953666 split increased to 2 itime 250499
itsplit 1
- acceleration/energy drift too large 8.71768505261655
- 18.7027501102351 split increased to 2 itime 284880
+ acceleration/energy drift too large 9.60363704417643
+ 41.0002241451348 split increased to 2 itime 250515
itsplit 1
- acceleration/energy drift too large 3.01831173965245
- 13.1914074345964 split increased to 2 itime 288434
+ acceleration/energy drift too large 6.81843958352194
+ 61.9698421949207 split increased to 2 itime 251527
itsplit 1
- acceleration/energy drift too large 12.7044713738884
- 64.1380603119273 split increased to 2 itime 289056
+ acceleration/energy drift too large 5.01191955199218
+ 18.1865685157832 split increased to 2 itime 251799
itsplit 1
-Velocities reset to random values, time 57999.80
- acceleration/energy drift too large 6.05774672607343
- 18.6687610707199 split increased to 2 itime 290218
+ acceleration/energy drift too large 7.14483123137104
+ 20.7932850361492 split increased to 2 itime 252226
itsplit 1
- acceleration/energy drift too large 3.81058126314949
- 17.3394360112247 split increased to 2 itime 291486
+ acceleration/energy drift too large 5.31798110030693
+ 31.6961813232419 split increased to 2 itime 252461
itsplit 1
- acceleration/energy drift too large 2.10302834353525
- 10.7492353405089 split increased to 2 itime 291877
+ acceleration/energy drift too large 4.15365906319537
+ 12.2946056996686 split increased to 2 itime 252486
itsplit 1
- acceleration/energy drift too large 8.43843898824744
- 35.3222359656586 split increased to 2 itime 292547
+ acceleration/energy drift too large 3.61167752280191
+ 10.1913311809426 split increased to 2 itime 252748
itsplit 1
- acceleration/energy drift too large 2.48813703262112
- 11.0771824142261 split increased to 2 itime 293442
+ acceleration/energy drift too large 4.40362732277444
+ 11.6782656860820 split increased to 2 itime 253114
itsplit 1
- acceleration/energy drift too large 4.21427453721844
- 13.5045095846096 split increased to 2 itime 294765
+ acceleration/energy drift too large 6.18158963135055
+ 46.7178019167412 split increased to 2 itime 253512
itsplit 1
- acceleration/energy drift too large 11.9678880049237
- 73.7514462316036 split increased to 2 itime 296397
+ acceleration/energy drift too large 5.03393247180098
+ 11.3332578439481 split increased to 2 itime 253844
itsplit 1
- acceleration/energy drift too large 2.25248980875874
- 11.3636190035195 split increased to 4 itime 296397
- itsplit 2
- acceleration/energy drift too large 6.42465597627872
- 20.2067456358300 split increased to 2 itime 297259
+ acceleration/energy drift too large 5.30979425206005
+ 29.1936964522308 split increased to 2 itime 254633
itsplit 1
- acceleration/energy drift too large 9.56793280863025
- 39.7068406493567 split increased to 2 itime 297884
+ acceleration/energy drift too large 3.19686669697974
+ 12.9021212289249 split increased to 2 itime 254634
itsplit 1
-Velocities reset to random values, time 59999.80
- REMD synchro at 300000
- ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
- MIN ii_write= 1
- REMD gather times= 97.6328125000000 0.000000000000000E+000
- REMD writing rst time= 3.906250000000000E-003
- REMD writing traj time= 0.000000000000000E+000
- NREP 16
-ACC 1 250.00000 0.66667 3
-ACC 2 260.00000 0.66667 3
-ACC 3 270.00000 0.33333 3
-ACC 4 280.00000 0.66667 3
-ACC 5 290.00000 0.66667 3
-ACC 6 300.00000 0.66667 3
-ACC 7 310.00000 1.00000 3
-ACC 8 320.00000 0.33333 3
-ACC 9 330.00000 0.66667 3
-ACC 10 340.00000 0.33333 3
-ACC 11 350.00000 0.66667 3
-ACC 12 360.00000 1.00000 3
-ACC 13 370.00000 1.00000 3
-ACC 14 380.00000 0.66667 3
-ACC 15 390.00000 1.00000 3
- REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 4.74653703100026
- 14.4961096534702 split increased to 2 itime 301817
+ acceleration/energy drift too large 4.79260254924054
+ 28.5667905576579 split increased to 2 itime 255478
itsplit 1
- acceleration/energy drift too large 7.79294451616467
- 20.2605284316772 split increased to 2 itime 301856
+ acceleration/energy drift too large 4.65602354960583
+ 17.7759492210056 split increased to 2 itime 255953
itsplit 1
- acceleration/energy drift too large 3.22683717777622
- 10.6507223254463 split increased to 2 itime 302334
+ acceleration/energy drift too large 11.3169090224622
+ 161.243959808749 split increased to 2 itime 257193
itsplit 1
- acceleration/energy drift too large 3.37558102706251
- 15.7899899006103 split increased to 2 itime 302786
+ acceleration/energy drift too large 8.06907814347340
+ 32.2475694627116 split increased to 2 itime 257260
itsplit 1
- acceleration/energy drift too large 9.26967582884234
- 40.5509422466356 split increased to 2 itime 302927
+ acceleration/energy drift too large 2.60388286259137
+ 12.1280694685579 split increased to 2 itime 259399
itsplit 1
- acceleration/energy drift too large 5.59396035020687
- 14.5198444548831 split increased to 2 itime 306770
+ acceleration/energy drift too large 6.45796619230735
+ 47.5864464837099 split increased to 2 itime 259484
itsplit 1
- acceleration/energy drift too large 3.81431259225134
- 10.0467368891205 split increased to 2 itime 308593
+ acceleration/energy drift too large 7.94273027558313
+ 66.5456672752248 split increased to 2 itime 259959
itsplit 1
- acceleration/energy drift too large 4.02776551332654
- 11.2812309617975 split increased to 2 itime 309015
+Velocities reset to random values, time 51999.80
+ acceleration/energy drift too large 3.88797891070357
+ 26.3442062749857 split increased to 2 itime 260276
itsplit 1
- acceleration/energy drift too large 2.40010355334840
- 15.3736922789987 split increased to 2 itime 309336
+ acceleration/energy drift too large 6.99349480011820
+ 47.7837841253383 split increased to 2 itime 260301
itsplit 1
-Velocities reset to random values, time 61999.80
- acceleration/energy drift too large 10.0426638739962
- 44.1413156188282 split increased to 2 itime 310607
+ acceleration/energy drift too large 1.57731869998459
+ 11.8990813440203 split increased to 4 itime 260301
itsplit 1
- acceleration/energy drift too large 5.74393443355665
- 16.9775995733477 split increased to 2 itime 310768
+ acceleration/energy drift too large 4.61447338962169
+ 22.9151619947389 split increased to 2 itime 260776
itsplit 1
- acceleration/energy drift too large 2.13155020622275
- 11.1737821320008 split increased to 2 itime 313941
+ acceleration/energy drift too large 7.17899670696612
+ 26.4749022442379 split increased to 2 itime 260862
itsplit 1
- acceleration/energy drift too large 2.56042198313778
- 14.4427752323447 split increased to 2 itime 314099
+ acceleration/energy drift too large 5.46685601351314
+ 17.8321954757611 split increased to 2 itime 261818
itsplit 1
- acceleration/energy drift too large 2.69219157590331
- 12.0399825642012 split increased to 2 itime 317072
+ acceleration/energy drift too large 8.37501437872455
+ 89.1916118826271 split increased to 2 itime 262814
itsplit 1
- acceleration/energy drift too large 4.65603573742887
- 14.5882500375727 split increased to 2 itime 317086
+ acceleration/energy drift too large 5.22467116630451
+ 17.0237090007236 split increased to 2 itime 263665
itsplit 1
- acceleration/energy drift too large 2.90391207842248
- 17.1380162404347 split increased to 2 itime 318942
+ acceleration/energy drift too large 5.71210911345283
+ 21.1408707305939 split increased to 2 itime 263901
itsplit 1
- acceleration/energy drift too large 2.47746229834933
- 15.9575194574532 split increased to 2 itime 319238
+ acceleration/energy drift too large 6.10003549896224
+ 23.5490643132228 split increased to 2 itime 263994
itsplit 1
-Velocities reset to random values, time 63999.80
- acceleration/energy drift too large 4.20284179212565
- 12.8997545432308 split increased to 2 itime 320525
+ acceleration/energy drift too large 8.20268850051587
+ 23.1777812019148 split increased to 2 itime 264177
itsplit 1
- acceleration/energy drift too large 1.59701709664048
- 11.1668861471805 split increased to 2 itime 320596
+ acceleration/energy drift too large 3.88188908844422
+ 13.9856854971536 split increased to 2 itime 264691
itsplit 1
- acceleration/energy drift too large 8.34237184387572
- 32.0298188717333 split increased to 2 itime 322320
+ acceleration/energy drift too large 3.59644744767693
+ 23.4348027889077 split increased to 2 itime 265041
itsplit 1
- acceleration/energy drift too large 5.22605080463165
- 12.5692654377719 split increased to 2 itime 322900
+ acceleration/energy drift too large 5.85747097230420
+ 18.3512257605687 split increased to 2 itime 266239
itsplit 1
- acceleration/energy drift too large 4.76944857336988
- 10.6149403068381 split increased to 2 itime 323261
+ acceleration/energy drift too large 2.55022222561286
+ 12.8061798642678 split increased to 2 itime 268645
itsplit 1
- acceleration/energy drift too large 5.56269874546165
- 16.3368748314025 split increased to 2 itime 325685
+ acceleration/energy drift too large 4.49085679966644
+ 16.3684860363880 split increased to 2 itime 269570
itsplit 1
- acceleration/energy drift too large 2.57593305191987
- 10.1350815779999 split increased to 2 itime 326332
+Velocities reset to random values, time 53999.80
+ acceleration/energy drift too large 5.25274366751194
+ 18.4603368822076 split increased to 2 itime 270538
itsplit 1
- acceleration/energy drift too large 4.32574893165141
- 15.0650563248663 split increased to 2 itime 327307
+ acceleration/energy drift too large 6.23882492153760
+ 17.5633522160038 split increased to 2 itime 272608
itsplit 1
-Velocities reset to random values, time 65999.80
- acceleration/energy drift too large 5.12058216374403
- 15.0524512452061 split increased to 2 itime 331794
+ acceleration/energy drift too large 3.85640416013364
+ 11.2906373571186 split increased to 2 itime 274105
itsplit 1
- acceleration/energy drift too large 4.24993209532194
- 12.7863340178675 split increased to 2 itime 332535
+ acceleration/energy drift too large 2.27744594892197
+ 12.2783170997514 split increased to 2 itime 274415
itsplit 1
- acceleration/energy drift too large 5.17274241673191
- 29.6883952022451 split increased to 2 itime 332829
+ acceleration/energy drift too large 5.47426144025225
+ 36.0315271901256 split increased to 2 itime 276125
itsplit 1
-Velocities reset to random values, time 67999.80
- acceleration/energy drift too large 5.15213827178948
- 16.2695456739890 split increased to 2 itime 344204
+ acceleration/energy drift too large 3.50232950588160
+ 19.7353095226570 split increased to 2 itime 276304
itsplit 1
- acceleration/energy drift too large 4.07124029064840
- 10.0726478693486 split increased to 2 itime 345745
+ acceleration/energy drift too large 8.17273252379029
+ 22.0871395331734 split increased to 2 itime 276917
itsplit 1
- acceleration/energy drift too large 5.25616946588270
- 16.5593491116070 split increased to 2 itime 346209
+ acceleration/energy drift too large 2.69832241928415
+ 11.4024695909039 split increased to 2 itime 276920
itsplit 1
- acceleration/energy drift too large 4.52521476440034
- 13.7603784691467 split increased to 2 itime 348191
+ acceleration/energy drift too large 5.19830199417168
+ 19.2870506887228 split increased to 2 itime 278296
itsplit 1
- acceleration/energy drift too large 2.20397750980659
- 14.2824377234908 split increased to 2 itime 348308
+ acceleration/energy drift too large 4.06193721784993
+ 17.8967177753917 split increased to 2 itime 278400
itsplit 1
- acceleration/energy drift too large 4.58559572673012
- 25.4467679743356 split increased to 2 itime 348309
+ acceleration/energy drift too large 4.76262838690433
+ 16.8576361345615 split increased to 2 itime 279030
itsplit 1
- acceleration/energy drift too large 5.37796800293809
- 14.7171658034760 split increased to 2 itime 348729
+ acceleration/energy drift too large 6.32215556102713
+ 18.6070140960166 split increased to 2 itime 279400
itsplit 1
- acceleration/energy drift too large 6.96841188002727
- 20.5603681985924 split increased to 2 itime 348803
+Velocities reset to random values, time 55999.80
+ acceleration/energy drift too large 9.53183291554470
+ 38.8386245693009 split increased to 2 itime 280549
itsplit 1
- acceleration/energy drift too large 10.2087258449308
- 55.4899463957382 split increased to 2 itime 348906
+ acceleration/energy drift too large 6.25186221347915
+ 24.9729745449266 split increased to 2 itime 284519
itsplit 1
- acceleration/energy drift too large 2.48444312235286
- 13.6864604356034 split increased to 4 itime 348906
- itsplit 2
-Velocities reset to random values, time 69999.80
- acceleration/energy drift too large 2.85042276529144
- 14.8938570559057 split increased to 2 itime 354678
+ acceleration/energy drift too large 3.65361022732287
+ 16.6195900592584 split increased to 2 itime 285728
itsplit 1
- acceleration/energy drift too large 6.18739217325295
- 23.0015837792323 split increased to 2 itime 354876
+ acceleration/energy drift too large 5.33403394746487
+ 26.1281201328799 split increased to 2 itime 285760
itsplit 1
- acceleration/energy drift too large 5.45728095297666
- 14.8425785080493 split increased to 2 itime 355510
+ acceleration/energy drift too large 2.62165596395872
+ 13.1436333511659 split increased to 2 itime 285761
itsplit 1
- acceleration/energy drift too large 3.25343752548132
- 19.7451451873440 split increased to 2 itime 355527
+ acceleration/energy drift too large 5.15436874113173
+ 11.9231750150784 split increased to 2 itime 285768
itsplit 1
- acceleration/energy drift too large 9.50833446953568
- 46.3578058378884 split increased to 2 itime 356093
+ acceleration/energy drift too large 7.16533442633403
+ 20.0645867637737 split increased to 2 itime 287397
itsplit 1
- acceleration/energy drift too large 3.83231910207820
- 10.3744572450315 split increased to 2 itime 357966
+ acceleration/energy drift too large 1.91625130967802
+ 11.5153196792092 split increased to 2 itime 287722
itsplit 1
- acceleration/energy drift too large 5.36318616680579
- 25.8391892864297 split increased to 2 itime 358925
+ acceleration/energy drift too large 8.82931554738403
+ 34.5773118577314 split increased to 2 itime 287851
itsplit 1
-Velocities reset to random values, time 71999.80
- acceleration/energy drift too large 2.90973210361151
- 17.1476770308735 split increased to 2 itime 362329
+ acceleration/energy drift too large 3.50626692461012
+ 11.9416730995477 split increased to 2 itime 287870
itsplit 1
- acceleration/energy drift too large 7.84096878915784
- 28.2417052063377 split increased to 2 itime 362901
+ acceleration/energy drift too large 5.24492781059974
+ 21.5243431484944 split increased to 2 itime 289264
itsplit 1
- acceleration/energy drift too large 4.65399675194030
- 15.3778785409094 split increased to 2 itime 363831
+Velocities reset to random values, time 57999.80
+ acceleration/energy drift too large 4.05468605190852
+ 10.8682178066819 split increased to 2 itime 290191
itsplit 1
- acceleration/energy drift too large 4.42167898696085
- 11.6821277965135 split increased to 2 itime 364639
+ acceleration/energy drift too large 9.29502144483686
+ 39.1096035695160 split increased to 2 itime 290298
itsplit 1
- acceleration/energy drift too large 5.58769738163232
- 13.8114588181142 split increased to 2 itime 365283
+ acceleration/energy drift too large 2.31173117760042
+ 12.0622389720738 split increased to 2 itime 290299
itsplit 1
- acceleration/energy drift too large 5.36183328656027
- 24.7726051738871 split increased to 2 itime 365598
+ acceleration/energy drift too large 3.54261923057887
+ 13.1195576565950 split increased to 2 itime 290506
itsplit 1
- acceleration/energy drift too large 7.76409936436296
- 21.4255424312454 split increased to 2 itime 366491
+ acceleration/energy drift too large 5.79536333255481
+ 23.5741534507117 split increased to 2 itime 292647
itsplit 1
- acceleration/energy drift too large 5.26867064214734
- 13.7162739685569 split increased to 2 itime 367022
+ acceleration/energy drift too large 5.99924730273468
+ 20.0698313414361 split increased to 2 itime 292718
itsplit 1
- acceleration/energy drift too large 6.44305467339040
- 14.8511611437300 split increased to 2 itime 368324
+ acceleration/energy drift too large 6.35924310780247
+ 16.2280087407269 split increased to 2 itime 292911
itsplit 1
-Velocities reset to random values, time 73999.80
- acceleration/energy drift too large 5.92956625141245
- 43.0606284961055 split increased to 2 itime 372219
+ acceleration/energy drift too large 5.82423666300645
+ 17.4629347582618 split increased to 2 itime 293751
itsplit 1
- acceleration/energy drift too large 5.52315712685407
- 19.5387265522369 split increased to 2 itime 374563
+ acceleration/energy drift too large 7.24553177111816
+ 32.5662412451276 split increased to 2 itime 294774
itsplit 1
- acceleration/energy drift too large 3.43899288073537
- 11.7659324369125 split increased to 2 itime 375728
+ acceleration/energy drift too large 6.36445641210212
+ 13.9138433683522 split increased to 2 itime 295849
itsplit 1
- acceleration/energy drift too large 4.84475825646286
- 13.7764264719732 split increased to 2 itime 375734
+ acceleration/energy drift too large 4.56658437011661
+ 14.1075785477974 split increased to 2 itime 296826
itsplit 1
- acceleration/energy drift too large 5.04884009027345
- 20.8502560117513 split increased to 2 itime 377660
+ acceleration/energy drift too large 4.54062199257411
+ 10.0371432287181 split increased to 2 itime 297975
itsplit 1
- acceleration/energy drift too large 3.19584780538516
- 13.5310421768747 split increased to 2 itime 378505
+ acceleration/energy drift too large 2.58573152638697
+ 10.5501840834612 split increased to 2 itime 298375
itsplit 1
- acceleration/energy drift too large 4.86305094892220
- 14.6269658258019 split increased to 2 itime 379341
+ acceleration/energy drift too large 11.5891608933544
+ 64.8807244383626 split increased to 2 itime 298484
itsplit 1
- acceleration/energy drift too large 4.94460215789803
- 12.0931183043119 split increased to 2 itime 379428
+ acceleration/energy drift too large 6.52639196492389
+ 15.5757699308264 split increased to 2 itime 298951
itsplit 1
-Velocities reset to random values, time 75999.80
- acceleration/energy drift too large 5.88913271427792
- 16.3185944028214 split increased to 2 itime 380389
+ acceleration/energy drift too large 7.79986462023410
+ 23.8326950552251 split increased to 2 itime 299991
itsplit 1
- acceleration/energy drift too large 5.65360772929155
- 17.8954382079814 split increased to 2 itime 381485
+Velocities reset to random values, time 59999.80
+ REMD synchro at 300000
+ ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 122.675781250000 0.000000000000000E+000
+ REMD writing rst time= 3.906250000000000E-003
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.66667 3
+ACC 2 260.00000 0.00000 3
+ACC 3 270.00000 1.00000 3
+ACC 4 280.00000 0.33333 3
+ACC 5 290.00000 1.00000 3
+ACC 6 300.00000 1.00000 3
+ACC 7 310.00000 0.33333 3
+ACC 8 320.00000 0.66667 3
+ACC 9 330.00000 0.66667 3
+ACC 10 340.00000 0.66667 3
+ACC 11 350.00000 0.33333 3
+ACC 12 360.00000 1.00000 3
+ACC 13 370.00000 1.00000 3
+ACC 14 380.00000 1.00000 3
+ACC 15 390.00000 1.00000 3
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 7.812500000000000E-003
+ acceleration/energy drift too large 6.07766675587740
+ 10.8241477766531 split increased to 2 itime 300133
itsplit 1
- acceleration/energy drift too large 5.09433865261189
- 13.3427607674305 split increased to 2 itime 381962
+ acceleration/energy drift too large 4.75846444841410
+ 14.5604650991464 split increased to 2 itime 303934
itsplit 1
- acceleration/energy drift too large 5.26599516519153
- 14.1947085510483 split increased to 2 itime 382105
+ acceleration/energy drift too large 5.22647671248841
+ 10.6215557321656 split increased to 2 itime 304175
itsplit 1
- acceleration/energy drift too large 4.27415700797396
- 13.6537837615552 split increased to 2 itime 382808
+ acceleration/energy drift too large 4.12123751922885
+ 10.4884747829284 split increased to 2 itime 304241
itsplit 1
- acceleration/energy drift too large 5.40570975007213
- 14.5138206458984 split increased to 2 itime 383030
+ acceleration/energy drift too large 3.44221399788850
+ 12.5272103618110 split increased to 2 itime 305570
itsplit 1
- acceleration/energy drift too large 4.51403786035482
- 29.3042018229721 split increased to 2 itime 383323
+ acceleration/energy drift too large 4.76812859718214
+ 11.9262480965619 split increased to 2 itime 306955
itsplit 1
- acceleration/energy drift too large 1.32865766422276
- 13.1091147284460 split increased to 2 itime 383324
+ acceleration/energy drift too large 4.05763667676570
+ 11.6018843772727 split increased to 2 itime 307011
itsplit 1
- acceleration/energy drift too large 7.16233616985799
- 22.6467833861321 split increased to 2 itime 383440
+ acceleration/energy drift too large 8.57919462477725
+ 33.3581529060793 split increased to 2 itime 307097
itsplit 1
- acceleration/energy drift too large 4.52262483069645
- 12.3507725155107 split increased to 2 itime 388153
+Velocities reset to random values, time 61999.80
+ acceleration/energy drift too large 6.92603373546451
+ 23.0425935316238 split increased to 2 itime 311284
itsplit 1
- acceleration/energy drift too large 3.66329581123763
- 16.0333805023704 split increased to 2 itime 389074
+ acceleration/energy drift too large 5.69419384421165
+ 10.6518772866196 split increased to 2 itime 311518
itsplit 1
-Velocities reset to random values, time 77999.80
- acceleration/energy drift too large 5.74824505189952
- 12.9411508192371 split increased to 2 itime 390419
+ acceleration/energy drift too large 4.36921418148261
+ 10.5453353318495 split increased to 2 itime 311609
itsplit 1
- acceleration/energy drift too large 2.47600976432689
- 13.8687791291948 split increased to 2 itime 391173
+ acceleration/energy drift too large 7.66272761309504
+ 27.8487547661130 split increased to 2 itime 312257
itsplit 1
- acceleration/energy drift too large 2.33220132956298
- 12.4915751738750 split increased to 2 itime 391613
+ acceleration/energy drift too large 2.63617479536375
+ 16.8144269054514 split increased to 2 itime 315902
itsplit 1
- acceleration/energy drift too large 2.28382221720213
- 11.9157019923583 split increased to 2 itime 392040
+ acceleration/energy drift too large 5.79319186200584
+ 10.1007897717378 split increased to 2 itime 316703
itsplit 1
- acceleration/energy drift too large 5.89903328416914
- 13.3085683449634 split increased to 2 itime 393620
+ acceleration/energy drift too large 5.27985600934854
+ 18.1388084599452 split increased to 2 itime 319001
itsplit 1
- acceleration/energy drift too large 5.20809103877739
- 13.1947744000292 split increased to 2 itime 394001
+ acceleration/energy drift too large 3.16937329679056
+ 24.1620605719490 split increased to 2 itime 319172
itsplit 1
- acceleration/energy drift too large 7.31882779213365
- 17.3734689082338 split increased to 2 itime 394245
+Velocities reset to random values, time 63999.80
+ acceleration/energy drift too large 3.79058375708654
+ 10.4544440528750 split increased to 2 itime 321177
itsplit 1
- acceleration/energy drift too large 2.29770061373230
- 10.5221353308330 split increased to 2 itime 394931
+ acceleration/energy drift too large 3.59098679493595
+ 12.6293077222021 split increased to 2 itime 325605
itsplit 1
- acceleration/energy drift too large 6.66221571906720
- 19.2388256450955 split increased to 2 itime 397376
+ acceleration/energy drift too large 4.83128899002368
+ 13.5463157451227 split increased to 2 itime 325964
itsplit 1
- acceleration/energy drift too large 5.06656286941232
- 13.1441434892435 split increased to 2 itime 398362
+ acceleration/energy drift too large 2.73760723337011
+ 14.6765139285750 split increased to 2 itime 326989
itsplit 1
- acceleration/energy drift too large 2.35865642825049
- 15.2514475652846 split increased to 2 itime 398909
+ acceleration/energy drift too large 3.44172973932176
+ 13.9426206532177 split increased to 2 itime 328675
itsplit 1
- acceleration/energy drift too large 3.10808383543609
- 11.8705551801477 split increased to 2 itime 398993
+ acceleration/energy drift too large 6.06097052407765
+ 14.8954531282660 split increased to 2 itime 329720
itsplit 1
- acceleration/energy drift too large 2.59118694266504
- 14.7477344312607 split increased to 2 itime 399080
+Velocities reset to random values, time 65999.80
+ acceleration/energy drift too large 5.11344591654875
+ 10.8060672290211 split increased to 2 itime 332612
itsplit 1
-Velocities reset to random values, time 79999.80
- REMD synchro at 400000
- ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
- MIN ii_write= 1
- REMD gather times= 129.925781250000 0.000000000000000E+000
- REMD writing rst time= 0.000000000000000E+000
- REMD writing traj time= 3.906250000000000E-003
- NREP 16
-ACC 1 250.00000 0.50000 4
-ACC 2 260.00000 0.50000 4
-ACC 3 270.00000 0.25000 4
-ACC 4 280.00000 0.50000 4
-ACC 5 290.00000 0.50000 4
-ACC 6 300.00000 0.75000 4
-ACC 7 310.00000 0.75000 4
-ACC 8 320.00000 0.25000 4
-ACC 9 330.00000 0.50000 4
-ACC 10 340.00000 0.50000 4
-ACC 11 350.00000 0.75000 4
-ACC 12 360.00000 1.00000 4
-ACC 13 370.00000 1.00000 4
-ACC 14 380.00000 0.75000 4
-ACC 15 390.00000 1.00000 4
- REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 5.11061343451897
- 12.6762882631184 split increased to 2 itime 401135
+ acceleration/energy drift too large 3.42383979993469
+ 22.5718390049174 split increased to 2 itime 332634
itsplit 1
- acceleration/energy drift too large 3.30732311257863
- 18.5484258103036 split increased to 2 itime 403015
+ acceleration/energy drift too large 2.67433160861011
+ 13.6487718252882 split increased to 2 itime 333274
itsplit 1
- acceleration/energy drift too large 2.71752742304277
- 13.0195883684556 split increased to 2 itime 403523
+ acceleration/energy drift too large 5.23068412448105
+ 21.0344405516192 split increased to 2 itime 335082
itsplit 1
- acceleration/energy drift too large 6.33609205293826
- 27.7659185130186 split increased to 2 itime 403836
+ acceleration/energy drift too large 7.75048509436381
+ 27.2706652588561 split increased to 2 itime 338775
itsplit 1
- acceleration/energy drift too large 2.19948474320004
- 10.5479060502446 split increased to 2 itime 404932
+Velocities reset to random values, time 67999.80
+ acceleration/energy drift too large 4.19274336283247
+ 11.2992188723966 split increased to 2 itime 342384
itsplit 1
- acceleration/energy drift too large 6.46239265103868
- 16.8963695502868 split increased to 2 itime 405389
+Velocities reset to random values, time 69999.80
+ acceleration/energy drift too large 2.62179598425635
+ 16.2468969877411 split increased to 2 itime 351204
itsplit 1
- acceleration/energy drift too large 3.76078390863811
- 10.3644593403161 split increased to 2 itime 405701
+ acceleration/energy drift too large 4.40465975334449
+ 13.1137697025318 split increased to 2 itime 351240
itsplit 1
- acceleration/energy drift too large 4.28617695927949
- 10.9699640550932 split increased to 2 itime 406213
+ acceleration/energy drift too large 5.03507271155133
+ 10.4560271961448 split increased to 2 itime 351249
itsplit 1
- acceleration/energy drift too large 4.39013645566034
- 19.8223488236473 split increased to 2 itime 406845
+ acceleration/energy drift too large 4.86608746470851
+ 25.0922468819268 split increased to 2 itime 353281
itsplit 1
- acceleration/energy drift too large 8.66175598231922
- 24.6498263090524 split increased to 2 itime 407678
+ acceleration/energy drift too large 8.74985933109997
+ 34.9316148544256 split increased to 2 itime 356677
itsplit 1
- acceleration/energy drift too large 5.12977947609520
- 11.7671156124732 split increased to 2 itime 409351
+ acceleration/energy drift too large 3.56406207258775
+ 10.4752887031890 split increased to 2 itime 356989
itsplit 1
-Velocities reset to random values, time 81999.80
- acceleration/energy drift too large 6.22284630174127
- 11.4025991035611 split increased to 2 itime 410687
+ acceleration/energy drift too large 5.61153750176249
+ 18.0620612870272 split increased to 2 itime 358116
itsplit 1
- acceleration/energy drift too large 4.31085688679568
- 12.3248449695206 split increased to 2 itime 411142
+ acceleration/energy drift too large 4.43861446085209
+ 22.0272133050345 split increased to 2 itime 358147
itsplit 1
- acceleration/energy drift too large 2.33167803048749
- 10.7509374705099 split increased to 2 itime 411882
+ acceleration/energy drift too large 5.91201889244300
+ 15.3791076086729 split increased to 2 itime 358737
itsplit 1
- acceleration/energy drift too large 6.90011729083356
- 18.8034345224998 split increased to 2 itime 412024
+ acceleration/energy drift too large 3.97160701871715
+ 10.8784136909497 split increased to 2 itime 358848
itsplit 1
- acceleration/energy drift too large 2.63019483905697
- 19.5851555203900 split increased to 2 itime 412504
+Velocities reset to random values, time 71999.80
+ acceleration/energy drift too large 4.76083594317882
+ 12.0414034238304 split increased to 2 itime 361313
itsplit 1
- acceleration/energy drift too large 4.85532308943637
- 12.0182830630077 split increased to 2 itime 413316
+ acceleration/energy drift too large 5.37586761620795
+ 17.5370386894735 split increased to 2 itime 364179
itsplit 1
- acceleration/energy drift too large 4.29246354871446
- 11.8856067831948 split increased to 2 itime 413931
+ acceleration/energy drift too large 6.22744230012241
+ 23.9264878326282 split increased to 2 itime 364666
itsplit 1
- acceleration/energy drift too large 4.53840861400948
- 17.1238981723967 split increased to 2 itime 414035
+ acceleration/energy drift too large 5.37849423933318
+ 28.7599246015068 split increased to 2 itime 365051
itsplit 1
- acceleration/energy drift too large 5.84783872870902
- 19.5279803825499 split increased to 2 itime 414164
+ acceleration/energy drift too large 5.15684759541444
+ 16.8220738832904 split increased to 2 itime 365749
itsplit 1
- acceleration/energy drift too large 4.82099367727505
- 25.1276989894918 split increased to 2 itime 415060
+ acceleration/energy drift too large 6.58153491584516
+ 23.5751270385877 split increased to 2 itime 366549
itsplit 1
- acceleration/energy drift too large 2.33431852584656
- 16.8733285222135 split increased to 2 itime 416187
+ acceleration/energy drift too large 1.88564641261838
+ 16.5285514906273 split increased to 2 itime 366550
itsplit 1
- acceleration/energy drift too large 6.46353480170789
- 19.7644890852479 split increased to 2 itime 417008
+Velocities reset to random values, time 73999.80
+ acceleration/energy drift too large 6.42819413746919
+ 19.2022623719648 split increased to 2 itime 370308
itsplit 1
- acceleration/energy drift too large 4.51326910594791
- 17.0610980702080 split increased to 2 itime 417355
+ acceleration/energy drift too large 7.68849979005426
+ 26.3712365349223 split increased to 2 itime 370741
itsplit 1
- acceleration/energy drift too large 5.40434312564802
- 26.7016838119556 split increased to 2 itime 419158
+ acceleration/energy drift too large 6.64359258953225
+ 17.6780292942082 split increased to 2 itime 373653
itsplit 1
- acceleration/energy drift too large 6.10329002472998
- 14.1290122828212 split increased to 2 itime 419516
+ acceleration/energy drift too large 5.36387204093286
+ 24.1448352998582 split increased to 2 itime 374632
itsplit 1
-Velocities reset to random values, time 83999.80
- acceleration/energy drift too large 4.31973832865928
- 17.8004480483302 split increased to 2 itime 420284
+ acceleration/energy drift too large 3.67087598742650
+ 10.5305977688170 split increased to 2 itime 375474
itsplit 1
- acceleration/energy drift too large 5.45537840621313
- 19.6062506444591 split increased to 2 itime 421590
+ acceleration/energy drift too large 11.1226298201210
+ 56.5640202913500 split increased to 2 itime 377670
itsplit 1
- acceleration/energy drift too large 8.54726150153755
- 32.5371884312401 split increased to 2 itime 421974
+ acceleration/energy drift too large 1.89087148150809
+ 11.4267198153424 split increased to 2 itime 378000
itsplit 1
- acceleration/energy drift too large 6.08987013233523
- 12.5654017126875 split increased to 2 itime 422063
+Velocities reset to random values, time 75999.80
+ acceleration/energy drift too large 8.98850266681585
+ 43.2493594683055 split increased to 2 itime 380523
itsplit 1
- acceleration/energy drift too large 3.88492805905722
- 15.8024635337514 split increased to 2 itime 422920
+ acceleration/energy drift too large 2.06816876996664
+ 12.9220015497403 split increased to 2 itime 380524
itsplit 1
- acceleration/energy drift too large 5.10437571940544
- 25.0579057698207 split increased to 2 itime 424792
+ acceleration/energy drift too large 9.60567614855503
+ 58.3210666213169 split increased to 2 itime 380836
itsplit 1
- acceleration/energy drift too large 7.03032558836901
- 22.3036698948097 split increased to 2 itime 425588
+ acceleration/energy drift too large 2.39090374777370
+ 17.0632962590724 split increased to 2 itime 380837
itsplit 1
- acceleration/energy drift too large 4.90739065440440
- 10.4721867156118 split increased to 2 itime 426238
+ acceleration/energy drift too large 3.29853904398010
+ 20.5214337491257 split increased to 2 itime 383563
itsplit 1
- acceleration/energy drift too large 6.52602620730483
- 14.8909415052468 split increased to 2 itime 426728
+ acceleration/energy drift too large 4.73880464773287
+ 13.5663174112965 split increased to 2 itime 383652
itsplit 1
- acceleration/energy drift too large 5.98175407128341
- 20.5144724858188 split increased to 2 itime 427133
+ acceleration/energy drift too large 7.29111174454555
+ 24.4818690256853 split increased to 2 itime 384278
itsplit 1
- acceleration/energy drift too large 5.10307921162576
- 16.1999087201499 split increased to 2 itime 429274
+ acceleration/energy drift too large 6.56997907179818
+ 22.8522790571525 split increased to 2 itime 384279
itsplit 1
- acceleration/energy drift too large 4.68771747446478
- 10.6026381069787 split increased to 2 itime 429725
+ acceleration/energy drift too large 2.70981536196542
+ 12.3358659913794 split increased to 2 itime 386253
itsplit 1
-Velocities reset to random values, time 85999.80
- acceleration/energy drift too large 12.6960614236824
- 49.1823031344523 split increased to 2 itime 430292
+ acceleration/energy drift too large 2.32102484710323
+ 17.0682482993278 split increased to 2 itime 387254
itsplit 1
- acceleration/energy drift too large 3.60707722689840
- 10.3837817025541 split increased to 2 itime 430371
+ acceleration/energy drift too large 2.66021524061225
+ 14.4614031356135 split increased to 2 itime 387298
itsplit 1
- acceleration/energy drift too large 3.25830209541275
- 13.2600823276660 split increased to 2 itime 431345
+ acceleration/energy drift too large 4.15397784121815
+ 12.3232270734992 split increased to 2 itime 388801
itsplit 1
- acceleration/energy drift too large 3.39585701881609
- 10.5475027294959 split increased to 2 itime 431840
+ acceleration/energy drift too large 4.75798586317919
+ 17.2318019328056 split increased to 2 itime 389015
itsplit 1
- acceleration/energy drift too large 8.39217844762826
- 35.0116353388863 split increased to 2 itime 433658
+ acceleration/energy drift too large 3.48376008575851
+ 27.0920657733166 split increased to 2 itime 389071
itsplit 1
- acceleration/energy drift too large 4.01791306725080
- 18.2215087917765 split increased to 2 itime 433659
+Velocities reset to random values, time 77999.80
+ acceleration/energy drift too large 9.34132822233123
+ 14.1299459352593 split increased to 2 itime 393325
itsplit 1
- acceleration/energy drift too large 5.34092845799762
- 23.5124086621844 split increased to 2 itime 433880
+ acceleration/energy drift too large 3.53975057094461
+ 29.3105358293453 split increased to 2 itime 397100
itsplit 1
- acceleration/energy drift too large 3.92402082131598
- 10.2127482571078 split increased to 2 itime 435523
+ acceleration/energy drift too large 10.0049920273749
+ 50.2397248626102 split increased to 2 itime 399388
itsplit 1
- acceleration/energy drift too large 5.38937790628387
- 14.9119444104233 split increased to 2 itime 435759
+ acceleration/energy drift too large 2.54711262704641
+ 12.6910927337916 split increased to 4 itime 399388
+ itsplit 2
+ acceleration/energy drift too large 5.46262086552822
+ 17.9983230473407 split increased to 2 itime 399797
itsplit 1
- acceleration/energy drift too large 4.42427788308877
- 20.7268692385256 split increased to 2 itime 436040
+Velocities reset to random values, time 79999.80
+ REMD synchro at 400000
+ ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 164.062500000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.75000 4
+ACC 2 260.00000 0.00000 4
+ACC 3 270.00000 0.75000 4
+ACC 4 280.00000 0.25000 4
+ACC 5 290.00000 1.00000 4
+ACC 6 300.00000 0.75000 4
+ACC 7 310.00000 0.50000 4
+ACC 8 320.00000 0.50000 4
+ACC 9 330.00000 0.75000 4
+ACC 10 340.00000 0.75000 4
+ACC 11 350.00000 0.50000 4
+ACC 12 360.00000 1.00000 4
+ACC 13 370.00000 0.75000 4
+ACC 14 380.00000 1.00000 4
+ACC 15 390.00000 1.00000 4
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 5.71207132172949
+ 12.9463594619800 split increased to 2 itime 400099
itsplit 1
- acceleration/energy drift too large 4.82817887745515
- 13.8918218665531 split increased to 2 itime 437558
+ acceleration/energy drift too large 8.34850791190807
+ 29.9277564895180 split increased to 2 itime 403073
itsplit 1
- acceleration/energy drift too large 4.90300010811251
- 27.3609081366820 split increased to 2 itime 438594
+ acceleration/energy drift too large 5.19373752054904
+ 15.6040608505331 split increased to 2 itime 403881
itsplit 1
-Velocities reset to random values, time 87999.80
- acceleration/energy drift too large 5.28670832167430
- 12.2281201077977 split increased to 2 itime 441931
+ acceleration/energy drift too large 7.46832581423188
+ 18.2111880301842 split increased to 2 itime 405282
itsplit 1
- acceleration/energy drift too large 6.49591111748349
- 11.9031252741567 split increased to 2 itime 442533
+ acceleration/energy drift too large 5.46596215770641
+ 10.3789247750593 split increased to 2 itime 405288
itsplit 1
- acceleration/energy drift too large 6.25475058386385
- 25.6151934481788 split increased to 2 itime 444106
+ acceleration/energy drift too large 2.38438004043562
+ 10.2868368387867 split increased to 2 itime 405927
itsplit 1
- acceleration/energy drift too large 4.52592848420134
- 13.2140037342282 split increased to 2 itime 445550
+ acceleration/energy drift too large 7.03732193903913
+ 18.2129980711924 split increased to 2 itime 407200
itsplit 1
- acceleration/energy drift too large 6.07212996310294
- 14.6781192246878 split increased to 2 itime 445676
+Velocities reset to random values, time 81999.80
+ acceleration/energy drift too large 5.03153305452181
+ 21.4339115048159 split increased to 2 itime 410151
itsplit 1
- acceleration/energy drift too large 2.80512745936832
- 11.5060826542009 split increased to 2 itime 447651
+ acceleration/energy drift too large 3.75853376985387
+ 14.5703104070751 split increased to 2 itime 411244
itsplit 1
- acceleration/energy drift too large 6.24756002209494
- 23.5621147825419 split increased to 2 itime 447694
+ acceleration/energy drift too large 6.02099667872600
+ 19.0143764076154 split increased to 2 itime 413063
itsplit 1
- acceleration/energy drift too large 4.15861406700537
- 16.3987321864479 split increased to 2 itime 448009
+ acceleration/energy drift too large 5.86298045495196
+ 34.6096099685146 split increased to 2 itime 416955
itsplit 1
- acceleration/energy drift too large 5.20226235832301
- 10.7247053817557 split increased to 2 itime 448548
+ acceleration/energy drift too large 5.14258718020759
+ 21.8064241015623 split increased to 2 itime 417013
itsplit 1
- acceleration/energy drift too large 4.85383700477519
- 13.0233505650366 split increased to 2 itime 449279
+ acceleration/energy drift too large 6.22110687087945
+ 10.2035958611021 split increased to 2 itime 417248
itsplit 1
-Velocities reset to random values, time 89999.80
- acceleration/energy drift too large 3.51797917116977
- 10.8955375010004 split increased to 2 itime 451736
+ acceleration/energy drift too large 3.09918909289270
+ 11.7704523921461 split increased to 2 itime 417583
itsplit 1
- acceleration/energy drift too large 5.65226369635506
- 10.3299455197518 split increased to 2 itime 451863
+ acceleration/energy drift too large 1.50679512475557
+ 13.3303051257955 split increased to 4 itime 417583
itsplit 1
- acceleration/energy drift too large 2.15100576006334
- 10.8596467679583 split increased to 2 itime 452671
+ acceleration/energy drift too large 6.70250994097654
+ 24.1937697163829 split increased to 2 itime 419896
itsplit 1
- acceleration/energy drift too large 6.12885156720130
- 15.9790310236215 split increased to 2 itime 454665
+Velocities reset to random values, time 83999.80
+ acceleration/energy drift too large 4.22194690913700
+ 13.8332714924942 split increased to 2 itime 423520
itsplit 1
- acceleration/energy drift too large 2.39374156646898
- 14.2501891512812 split increased to 2 itime 455404
+ acceleration/energy drift too large 5.82232540138945
+ 16.3663344713537 split increased to 2 itime 424037
itsplit 1
- acceleration/energy drift too large 6.27439286786460
- 10.9750959098752 split increased to 2 itime 455750
+ acceleration/energy drift too large 3.99607050498344
+ 14.9605798269824 split increased to 2 itime 424718
itsplit 1
- acceleration/energy drift too large 4.12817220451532
- 12.4544838359192 split increased to 2 itime 456506
+ acceleration/energy drift too large 4.91701955234869
+ 28.6639978719811 split increased to 2 itime 424908
itsplit 1
- acceleration/energy drift too large 2.18053048961733
- 12.0130069851409 split increased to 2 itime 458158
+ acceleration/energy drift too large 4.25128758035625
+ 21.6899946168418 split increased to 2 itime 427208
itsplit 1
- acceleration/energy drift too large 9.87629172788394
- 44.6582593158087 split increased to 2 itime 458219
+ acceleration/energy drift too large 3.71294185839611
+ 16.5713878139662 split increased to 2 itime 427255
itsplit 1
- acceleration/energy drift too large 3.47319198122790
- 13.2534964334002 split increased to 2 itime 458252
+Velocities reset to random values, time 85999.80
+ acceleration/energy drift too large 2.96462232888096
+ 10.0834846412296 split increased to 2 itime 430253
itsplit 1
-Velocities reset to random values, time 91999.80
- acceleration/energy drift too large 7.02423900924881
- 21.5527013430013 split increased to 2 itime 460378
+ acceleration/energy drift too large 5.59487437996206
+ 27.9843237756155 split increased to 2 itime 430869
itsplit 1
- acceleration/energy drift too large 4.71945508631981
- 14.2496205191637 split increased to 2 itime 462266
+ acceleration/energy drift too large 5.13294587815154
+ 24.4546885548349 split increased to 2 itime 432617
itsplit 1
- acceleration/energy drift too large 4.54705245447910
- 10.9172622606431 split increased to 2 itime 463862
+ acceleration/energy drift too large 5.29659024530973
+ 26.5201387412203 split increased to 2 itime 433343
itsplit 1
- acceleration/energy drift too large 5.78703756262989
- 11.3302491782032 split increased to 2 itime 465475
+ acceleration/energy drift too large 3.00501816602540
+ 12.9375428237120 split increased to 2 itime 433344
itsplit 1
- acceleration/energy drift too large 3.89063033770301
- 14.4233856777009 split increased to 2 itime 466792
+ acceleration/energy drift too large 3.73365910015374
+ 14.5351590386227 split increased to 2 itime 433390
itsplit 1
- acceleration/energy drift too large 3.99688747537146
- 14.9878089882256 split increased to 2 itime 467626
+ acceleration/energy drift too large 4.32293666268891
+ 19.6627409949905 split increased to 2 itime 433709
itsplit 1
- acceleration/energy drift too large 4.32413291563623
- 10.1718861498166 split increased to 2 itime 468236
+ acceleration/energy drift too large 6.52465870186193
+ 29.9768949391426 split increased to 2 itime 434694
itsplit 1
- acceleration/energy drift too large 3.98509021323454
- 11.7826777728994 split increased to 2 itime 468389
+ acceleration/energy drift too large 5.37484028193743
+ 14.7511999134078 split increased to 2 itime 435178
itsplit 1
- acceleration/energy drift too large 10.1464104273359
- 48.7681491536489 split increased to 2 itime 468918
+ acceleration/energy drift too large 4.07129818583356
+ 13.8266906513137 split increased to 2 itime 436408
itsplit 1
-Velocities reset to random values, time 93999.80
- acceleration/energy drift too large 4.86613936943603
- 18.3132804898443 split increased to 2 itime 470376
+ acceleration/energy drift too large 5.30288671343334
+ 16.5228103301032 split increased to 2 itime 437200
itsplit 1
- acceleration/energy drift too large 3.98714623316026
- 11.0698303331868 split increased to 2 itime 470908
+ acceleration/energy drift too large 3.61185926503092
+ 11.4760999284788 split increased to 2 itime 437348
itsplit 1
- acceleration/energy drift too large 6.62831604728312
- 36.4805471348338 split increased to 2 itime 471810
+ acceleration/energy drift too large 7.09496473299269
+ 22.1762007359791 split increased to 2 itime 437960
itsplit 1
- acceleration/energy drift too large 4.60853781155378
- 22.9066776441411 split increased to 2 itime 472259
+ acceleration/energy drift too large 3.36766165064590
+ 13.1774297629055 split increased to 2 itime 439688
itsplit 1
- acceleration/energy drift too large 3.49590535846335
- 10.4338408307509 split increased to 2 itime 472456
+Velocities reset to random values, time 87999.80
+ acceleration/energy drift too large 6.00287588822552
+ 25.4985104983943 split increased to 2 itime 440793
itsplit 1
- acceleration/energy drift too large 2.34004076744622
- 15.9758696476486 split increased to 2 itime 473520
+ acceleration/energy drift too large 6.89476470137271
+ 19.3185433577334 split increased to 2 itime 440802
itsplit 1
- acceleration/energy drift too large 5.06863230167286
- 11.4729369685476 split increased to 2 itime 473986
+ acceleration/energy drift too large 4.84382504494316
+ 25.1129951350233 split increased to 2 itime 440829
itsplit 1
- acceleration/energy drift too large 9.40053480341076
- 25.8170022706007 split increased to 2 itime 478842
+ acceleration/energy drift too large 3.98818766405409
+ 19.1643710214830 split increased to 2 itime 441861
itsplit 1
-Velocities reset to random values, time 95999.80
- acceleration/energy drift too large 4.17974382314440
- 15.1054815276154 split increased to 2 itime 480873
+ acceleration/energy drift too large 4.31561243948357
+ 11.6071671658382 split increased to 2 itime 442409
itsplit 1
- acceleration/energy drift too large 4.28547242828707
- 23.8327738570182 split increased to 2 itime 480981
+ acceleration/energy drift too large 7.75629182316262
+ 30.6715202558308 split increased to 2 itime 443145
itsplit 1
- acceleration/energy drift too large 4.41730348729905
- 12.8143764568801 split increased to 2 itime 481744
+ acceleration/energy drift too large 8.10905156776023
+ 31.7586078839683 split increased to 2 itime 443526
itsplit 1
- acceleration/energy drift too large 2.29803000183096
- 11.5941071493627 split increased to 2 itime 485037
+ acceleration/energy drift too large 5.61722516667647
+ 18.4211097751804 split increased to 2 itime 443804
itsplit 1
- acceleration/energy drift too large 4.90596696578139
- 15.1846360911404 split increased to 2 itime 485666
+ acceleration/energy drift too large 2.98849428189056
+ 11.7024416616717 split increased to 2 itime 445676
itsplit 1
- acceleration/energy drift too large 5.63749678716790
- 19.6654681429800 split increased to 2 itime 486479
+ acceleration/energy drift too large 4.60323295168567
+ 28.0008959564913 split increased to 2 itime 445720
itsplit 1
- acceleration/energy drift too large 8.43706781127981
- 23.7723606001725 split increased to 2 itime 487014
+ acceleration/energy drift too large 2.00135401562538
+ 10.1340731634422 split increased to 2 itime 445967
itsplit 1
- acceleration/energy drift too large 7.66545458724698
- 17.0248186037216 split increased to 2 itime 488881
+ acceleration/energy drift too large 6.79474589439384
+ 22.2844299570468 split increased to 2 itime 446222
itsplit 1
-Velocities reset to random values, time 97999.80
- acceleration/energy drift too large 4.31780779411841
- 15.0031465249818 split increased to 2 itime 493900
+ acceleration/energy drift too large 6.05841335495080
+ 22.7832718425835 split increased to 2 itime 447086
itsplit 1
- acceleration/energy drift too large 4.21032311619180
- 12.1958796697122 split increased to 2 itime 493947
+ acceleration/energy drift too large 5.47025757241198
+ 21.1806063967866 split increased to 2 itime 447413
itsplit 1
- acceleration/energy drift too large 4.79088892698944
- 14.7868572050007 split increased to 2 itime 494400
+ acceleration/energy drift too large 6.28227899298396
+ 17.4067619201100 split increased to 2 itime 447775
itsplit 1
- acceleration/energy drift too large 3.62481815209525
- 10.6418292867908 split increased to 2 itime 495518
+ acceleration/energy drift too large 2.58664406879878
+ 19.3284809823980 split increased to 2 itime 449608
itsplit 1
- acceleration/energy drift too large 10.5780597457274
- 54.8082107813631 split increased to 2 itime 496098
+Velocities reset to random values, time 89999.80
+ acceleration/energy drift too large 5.20953815531127
+ 18.6396952186743 split increased to 2 itime 450890
itsplit 1
- acceleration/energy drift too large 2.43518761761194
- 12.3266628353730 split increased to 2 itime 496806
+ acceleration/energy drift too large 3.32712756977863
+ 12.1814485829973 split increased to 2 itime 452449
itsplit 1
-Velocities reset to random values, time 99999.80
- REMD synchro at 500000
- ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
- MIN ii_write= 1
- REMD gather times= 162.593750000000 0.000000000000000E+000
- REMD writing rst time= 3.906250000000000E-003
- REMD writing traj time= 0.000000000000000E+000
- NREP 16
-ACC 1 250.00000 0.40000 5
-ACC 2 260.00000 0.40000 5
-ACC 3 270.00000 0.20000 5
-ACC 4 280.00000 0.60000 5
-ACC 5 290.00000 0.40000 5
-ACC 6 300.00000 0.80000 5
-ACC 7 310.00000 0.80000 5
-ACC 8 320.00000 0.40000 5
-ACC 9 330.00000 0.40000 5
-ACC 10 340.00000 0.60000 5
-ACC 11 350.00000 0.80000 5
-ACC 12 360.00000 1.00000 5
-ACC 13 370.00000 1.00000 5
-ACC 14 380.00000 0.80000 5
-ACC 15 390.00000 1.00000 5
- REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 7.15090197406555
- 14.0645720430171 split increased to 2 itime 501736
+ acceleration/energy drift too large 4.69457675801215
+ 11.0673247789955 split increased to 2 itime 452609
itsplit 1
- acceleration/energy drift too large 3.58024087776764
- 10.0464644268008 split increased to 2 itime 502924
+ acceleration/energy drift too large 4.20155102300153
+ 25.4388516898503 split increased to 2 itime 453514
itsplit 1
- acceleration/energy drift too large 7.65617221324492
- 22.8151985448608 split increased to 2 itime 505020
+ acceleration/energy drift too large 7.58441117674498
+ 26.9112795896092 split increased to 2 itime 455123
itsplit 1
- acceleration/energy drift too large 4.36782292575687
- 10.8270829292355 split increased to 2 itime 506199
+ acceleration/energy drift too large 6.67456474609787
+ 14.6651365023740 split increased to 2 itime 456098
itsplit 1
- acceleration/energy drift too large 3.27854208757455
- 11.8549107657839 split increased to 2 itime 506365
+ acceleration/energy drift too large 6.68289405989964
+ 11.6684158997720 split increased to 2 itime 456842
itsplit 1
- acceleration/energy drift too large 7.47767649023221
- 19.5100383710146 split increased to 2 itime 506539
+ acceleration/energy drift too large 4.33883048944411
+ 12.6286251816921 split increased to 2 itime 457257
itsplit 1
- acceleration/energy drift too large 2.64689822516528
- 10.0704019912687 split increased to 2 itime 506750
+ acceleration/energy drift too large 4.13463669355379
+ 10.9748535478564 split increased to 2 itime 457280
itsplit 1
- acceleration/energy drift too large 4.49944382750580
- 14.4739559078128 split increased to 2 itime 508498
+ acceleration/energy drift too large 3.43849825159746
+ 12.8110401398300 split increased to 2 itime 457621
itsplit 1
- acceleration/energy drift too large 6.15888973930567
- 19.3377744191351 split increased to 2 itime 509360
+ acceleration/energy drift too large 3.62053743236681
+ 15.6078027805415 split increased to 2 itime 459207
itsplit 1
- acceleration/energy drift too large 2.77784289725985
- 14.1436420983081 split increased to 2 itime 509561
+ acceleration/energy drift too large 5.25937279029496
+ 34.4016809009295 split increased to 2 itime 459934
itsplit 1
- acceleration/energy drift too large 3.99007158454701
- 11.9182554245637 split increased to 2 itime 509577
+Velocities reset to random values, time 91999.80
+ acceleration/energy drift too large 5.12353780297772
+ 36.8983886338051 split increased to 2 itime 460113
itsplit 1
- acceleration/energy drift too large 5.74501099449596
- 11.6901196601102 split increased to 2 itime 509735
+ acceleration/energy drift too large 6.80772422237991
+ 26.2283834026153 split increased to 2 itime 462999
itsplit 1
- acceleration/energy drift too large 5.88040936301462
- 11.6573588186665 split increased to 2 itime 509802
+ acceleration/energy drift too large 2.77741493051902
+ 10.1092428033650 split increased to 2 itime 463566
itsplit 1
- acceleration/energy drift too large 6.26011408290629
- 13.7386167556546 split increased to 2 itime 509874
+ acceleration/energy drift too large 5.24187751196089
+ 11.8194547437371 split increased to 2 itime 463576
itsplit 1
-Velocities reset to random values, time 101999.80
- acceleration/energy drift too large 4.21125761457524
- 12.1983952189330 split increased to 2 itime 518342
+ acceleration/energy drift too large 4.01428360568487
+ 13.8739675118642 split increased to 2 itime 464141
itsplit 1
-Velocities reset to random values, time 103999.80
- acceleration/energy drift too large 3.61072431946663
- 13.9585517990033 split increased to 2 itime 520671
+ acceleration/energy drift too large 5.69419784607206
+ 38.3764478752122 split increased to 2 itime 465976
itsplit 1
- acceleration/energy drift too large 3.65496522276421
- 18.9283304896629 split increased to 2 itime 521009
+ acceleration/energy drift too large 13.2042929316216
+ 58.6271951177432 split increased to 2 itime 466636
itsplit 1
- acceleration/energy drift too large 1.41738129376700
- 10.3398661922129 split increased to 2 itime 523905
+ acceleration/energy drift too large 2.63567633549479
+ 11.6403508601015 split increased to 2 itime 467472
itsplit 1
- acceleration/energy drift too large 6.48253235903706
- 16.3191661155539 split increased to 2 itime 525276
+Velocities reset to random values, time 93999.80
+ acceleration/energy drift too large 5.10546285865149
+ 16.4005552628492 split increased to 2 itime 472599
itsplit 1
- acceleration/energy drift too large 3.43333478825362
- 10.8020506014827 split increased to 2 itime 526002
+ acceleration/energy drift too large 5.75447062513305
+ 20.8641855559396 split increased to 2 itime 475800
itsplit 1
- acceleration/energy drift too large 4.41089903756250
- 11.4984319793774 split increased to 2 itime 527200
+ acceleration/energy drift too large 3.74766873335163
+ 11.7735913214451 split increased to 2 itime 478245
itsplit 1
- acceleration/energy drift too large 5.33393294222631
- 31.6717702287395 split increased to 2 itime 527297
+ acceleration/energy drift too large 8.06562039215200
+ 23.3925671940576 split increased to 2 itime 478525
itsplit 1
- acceleration/energy drift too large 4.26370786243276
- 21.2369359082720 split increased to 2 itime 528303
+Velocities reset to random values, time 95999.80
+ acceleration/energy drift too large 6.84343729725816
+ 32.9079266535098 split increased to 2 itime 481310
itsplit 1
-Velocities reset to random values, time 105999.80
- acceleration/energy drift too large 6.31675814665906
- 20.7008860997452 split increased to 2 itime 531317
+ acceleration/energy drift too large 9.17581477500274
+ 41.0853030940486 split increased to 2 itime 482963
itsplit 1
- acceleration/energy drift too large 4.10085352194936
- 13.9638540550746 split increased to 2 itime 532031
+ acceleration/energy drift too large 6.28070625966611
+ 17.7302519675813 split increased to 2 itime 483046
itsplit 1
- acceleration/energy drift too large 8.12110006401335
- 14.9060491176364 split increased to 2 itime 532506
+ acceleration/energy drift too large 4.21710733803607
+ 18.4115697520822 split increased to 2 itime 485275
itsplit 1
- acceleration/energy drift too large 5.26138837806396
- 12.9617736032603 split increased to 2 itime 532938
+ acceleration/energy drift too large 4.80342092214674
+ 16.0980679382606 split increased to 2 itime 487662
itsplit 1
- acceleration/energy drift too large 6.34915258620975
- 27.0294550968473 split increased to 2 itime 533537
+ acceleration/energy drift too large 4.32570920881215
+ 10.4742493037187 split increased to 2 itime 488983
itsplit 1
- acceleration/energy drift too large 5.39843812694689
- 32.0670035331437 split increased to 2 itime 533851
+ acceleration/energy drift too large 6.12506048028423
+ 20.7106424959836 split increased to 2 itime 489936
itsplit 1
- acceleration/energy drift too large 8.43388808958597
- 31.0332982252897 split increased to 2 itime 535975
+Velocities reset to random values, time 97999.80
+ acceleration/energy drift too large 8.44801155346415
+ 34.2112031501455 split increased to 2 itime 490094
itsplit 1
- acceleration/energy drift too large 3.98664727400218
- 12.8690286732409 split increased to 2 itime 536047
+ acceleration/energy drift too large 5.29713693828657
+ 12.9308979369603 split increased to 2 itime 494036
itsplit 1
- acceleration/energy drift too large 5.65886765195689
- 15.0566216784200 split increased to 2 itime 536450
+ acceleration/energy drift too large 3.40748426011928
+ 13.6193321782272 split increased to 2 itime 494332
itsplit 1
- acceleration/energy drift too large 3.43991802845328
- 16.2062307664002 split increased to 2 itime 536552
+ acceleration/energy drift too large 5.10659605191796
+ 12.7078219685672 split increased to 2 itime 496332
itsplit 1
- acceleration/energy drift too large 5.01547110121234
- 15.1667229493659 split increased to 2 itime 539720
+ acceleration/energy drift too large 5.15881023967515
+ 10.2174486428275 split increased to 2 itime 497933
itsplit 1
-Velocities reset to random values, time 107999.80
- acceleration/energy drift too large 7.87448028222108
- 27.3989366754223 split increased to 2 itime 540471
+ acceleration/energy drift too large 3.30927059995153
+ 11.2460850499674 split increased to 2 itime 498076
itsplit 1
- acceleration/energy drift too large 5.77902010974629
- 11.9748763076863 split increased to 2 itime 541051
+ acceleration/energy drift too large 2.55086427188497
+ 14.8923659481319 split increased to 2 itime 498133
itsplit 1
- acceleration/energy drift too large 5.33699347798072
- 13.9892075498337 split increased to 2 itime 541208
+ acceleration/energy drift too large 3.51134911349549
+ 10.9459869404619 split increased to 2 itime 498326
itsplit 1
- acceleration/energy drift too large 9.38682500375998
- 31.9222899071623 split increased to 2 itime 544767
+ acceleration/energy drift too large 8.79102005154873
+ 20.9653351508991 split increased to 2 itime 498933
itsplit 1
- acceleration/energy drift too large 3.63209847135860
- 11.1359345510231 split increased to 2 itime 546355
+Velocities reset to random values, time 99999.80
+ REMD synchro at 500000
+ ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 205.101562500000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.80000 5
+ACC 2 260.00000 0.00000 5
+ACC 3 270.00000 0.80000 5
+ACC 4 280.00000 0.40000 5
+ACC 5 290.00000 0.80000 5
+ACC 6 300.00000 0.60000 5
+ACC 7 310.00000 0.60000 5
+ACC 8 320.00000 0.60000 5
+ACC 9 330.00000 0.60000 5
+ACC 10 340.00000 0.80000 5
+ACC 11 350.00000 0.60000 5
+ACC 12 360.00000 1.00000 5
+ACC 13 370.00000 0.80000 5
+ACC 14 380.00000 1.00000 5
+ACC 15 390.00000 1.00000 5
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 8.32256653578622
+ 34.6181709004767 split increased to 2 itime 500413
itsplit 1
- acceleration/energy drift too large 7.35214171932488
- 23.1829772959672 split increased to 2 itime 546405
+ acceleration/energy drift too large 2.82305846646002
+ 21.4499384719614 split increased to 2 itime 502501
itsplit 1
- acceleration/energy drift too large 2.62828269325847
- 13.1883616551442 split increased to 4 itime 546405
+ acceleration/energy drift too large 4.30266502961531
+ 30.1477348065987 split increased to 2 itime 504960
itsplit 1
- acceleration/energy drift too large 7.93893383040352
- 26.4213327538757 split increased to 2 itime 548348
+Velocities reset to random values, time 101999.80
+ acceleration/energy drift too large 3.64222416352689
+ 11.4110799135266 split increased to 2 itime 510653
itsplit 1
- acceleration/energy drift too large 5.92571275280044
- 10.8901953566925 split increased to 2 itime 548349
+ acceleration/energy drift too large 4.61414259403940
+ 10.9733112610136 split increased to 2 itime 514159
itsplit 1
- acceleration/energy drift too large 7.83055542072847
- 17.6110503066646 split increased to 2 itime 548782
+ acceleration/energy drift too large 5.97565686882792
+ 25.9069867717770 split increased to 2 itime 516855
itsplit 1
- acceleration/energy drift too large 4.79160474831111
- 10.1288108532966 split increased to 2 itime 549821
+Velocities reset to random values, time 103999.80
+ acceleration/energy drift too large 4.01640846294708
+ 11.7117082466496 split increased to 2 itime 521660
itsplit 1
-Velocities reset to random values, time 109999.80
- acceleration/energy drift too large 12.3862301115242
- 70.0068520721199 split increased to 2 itime 552933
+Velocities reset to random values, time 105999.80
+ acceleration/energy drift too large 2.91066343325500
+ 18.5242751047258 split increased to 2 itime 532895
itsplit 1
- acceleration/energy drift too large 7.07204517663503
- 33.2502250959477 split increased to 2 itime 553121
+ acceleration/energy drift too large 4.73136076427247
+ 11.4004636651319 split increased to 2 itime 534289
itsplit 1
- acceleration/energy drift too large 2.67288482498129
- 18.1086121852243 split increased to 2 itime 555413
+ acceleration/energy drift too large 4.02742079827788
+ 12.3340182529647 split increased to 2 itime 535238
itsplit 1
- acceleration/energy drift too large 7.73211446626071
- 28.0986147299517 split increased to 2 itime 556193
+ acceleration/energy drift too large 4.18548686661115
+ 11.0246835252392 split increased to 2 itime 535281
itsplit 1
- acceleration/energy drift too large 6.27120131512814
- 16.6056621058615 split increased to 2 itime 556431
+ acceleration/energy drift too large 7.26372518172864
+ 36.2219230160685 split increased to 2 itime 537079
itsplit 1
- acceleration/energy drift too large 6.53545401145014
- 17.3181702214668 split increased to 2 itime 557186
+ acceleration/energy drift too large 5.14035389938236
+ 11.7327691344663 split increased to 2 itime 538689
itsplit 1
- acceleration/energy drift too large 2.47596547907026
- 10.4208805035151 split increased to 2 itime 557252
+Velocities reset to random values, time 107999.80
+ acceleration/energy drift too large 4.51563341206380
+ 18.2265785388783 split increased to 2 itime 543148
itsplit 1
- acceleration/energy drift too large 5.02568288497151
- 16.0846477484121 split increased to 2 itime 557615
+ acceleration/energy drift too large 6.98600930187806
+ 22.0281616780724 split increased to 2 itime 546150
itsplit 1
- acceleration/energy drift too large 5.07857505966143
- 13.2435574291324 split increased to 2 itime 558569
+ acceleration/energy drift too large 9.44138902436643
+ 42.8546790236988 split increased to 2 itime 547997
itsplit 1
- acceleration/energy drift too large 3.86205116364816
- 12.9721389775296 split increased to 2 itime 559280
+Velocities reset to random values, time 109999.80
+ acceleration/energy drift too large 7.33555091066331
+ 21.2409581249673 split increased to 2 itime 553375
itsplit 1
-Velocities reset to random values, time 111999.80
- acceleration/energy drift too large 2.99030253767552
- 13.9266456705530 split increased to 2 itime 562241
+ acceleration/energy drift too large 8.40346215240483
+ 34.6060139412084 split increased to 2 itime 555425
itsplit 1
- acceleration/energy drift too large 3.38108237836890
- 10.7653768653146 split increased to 2 itime 562501
+ acceleration/energy drift too large 5.08160965493349
+ 26.5305101209948 split increased to 2 itime 555449
itsplit 1
- acceleration/energy drift too large 5.54353967446682
- 22.1760458471457 split increased to 2 itime 562868
+ acceleration/energy drift too large 2.19775154762170
+ 11.6997216870408 split increased to 2 itime 557387
itsplit 1
- acceleration/energy drift too large 5.21104323841252
- 17.3041008048135 split increased to 2 itime 563785
+ acceleration/energy drift too large 1.47915811498575
+ 11.4181550998662 split increased to 2 itime 558458
itsplit 1
- acceleration/energy drift too large 2.84510021935849
- 23.6072311408185 split increased to 2 itime 564119
+ acceleration/energy drift too large 7.40674688751249
+ 25.7980250531580 split increased to 2 itime 558603
itsplit 1
- acceleration/energy drift too large 4.58382816243769
- 15.8429116750557 split increased to 2 itime 565004
+ acceleration/energy drift too large 2.48970509995056
+ 17.5507929255567 split increased to 2 itime 559965
itsplit 1
- acceleration/energy drift too large 5.81288732478330
- 15.2971118703362 split increased to 2 itime 565368
+Velocities reset to random values, time 111999.80
+ acceleration/energy drift too large 5.86918439243631
+ 12.4501797213461 split increased to 2 itime 562926
itsplit 1
- acceleration/energy drift too large 5.62161271126533
- 14.5412071734199 split increased to 2 itime 565424
+ acceleration/energy drift too large 4.94862795250665
+ 17.1223079582701 split increased to 2 itime 563105
itsplit 1
- acceleration/energy drift too large 7.19595325174469
- 21.4820865381036 split increased to 2 itime 565650
+ acceleration/energy drift too large 3.34733629114778
+ 22.1435474310822 split increased to 2 itime 563904
itsplit 1
- acceleration/energy drift too large 6.63418224917685
- 26.1868011849154 split increased to 2 itime 565762
+ acceleration/energy drift too large 3.49793975071332
+ 15.0572661539993 split increased to 2 itime 565582
itsplit 1
- acceleration/energy drift too large 3.70944257010536
- 11.1219440765609 split increased to 2 itime 566604
+ acceleration/energy drift too large 4.94365652341386
+ 10.8167815942916 split increased to 2 itime 565600
itsplit 1
- acceleration/energy drift too large 4.30092461424052
- 16.9825164511491 split increased to 2 itime 566939
+ acceleration/energy drift too large 2.13497412849550
+ 12.5559497501989 split increased to 2 itime 567167
itsplit 1
- acceleration/energy drift too large 6.02749697911174
- 11.0830550784154 split increased to 2 itime 567105
+ acceleration/energy drift too large 6.29262639367615
+ 10.7149302190480 split increased to 2 itime 568237
itsplit 1
- acceleration/energy drift too large 3.51986092433453
- 10.6109347338683 split increased to 2 itime 568492
+ acceleration/energy drift too large 3.90945429151435
+ 15.2573143048390 split increased to 2 itime 568542
itsplit 1
- acceleration/energy drift too large 4.82972775258408
- 15.2723308027605 split increased to 2 itime 569074
+ acceleration/energy drift too large 5.20493539487758
+ 10.7128442098068 split increased to 2 itime 568849
itsplit 1
- acceleration/energy drift too large 4.65679985304098
- 11.4933886483429 split increased to 2 itime 569284
+ acceleration/energy drift too large 2.54095273602809
+ 16.3004797274468 split increased to 2 itime 569406
itsplit 1
Velocities reset to random values, time 113999.80
- acceleration/energy drift too large 7.54941569471367
- 31.7275370125797 split increased to 2 itime 571717
- itsplit 1
- acceleration/energy drift too large 6.96021050632536
- 28.2899032577741 split increased to 2 itime 575246
- itsplit 1
- acceleration/energy drift too large 1.33892218407015
- 10.4798611409334 split increased to 2 itime 577089
- itsplit 1
- acceleration/energy drift too large 4.10393752413878
- 12.3270904550999 split increased to 2 itime 577239
- itsplit 1
-Velocities reset to random values, time 115999.80
- acceleration/energy drift too large 6.13119094094969
- 11.8910217358431 split increased to 2 itime 580132
+ acceleration/energy drift too large 9.17742326968023
+ 29.0544029524750 split increased to 2 itime 570936
itsplit 1
- acceleration/energy drift too large 6.83157967442031
- 15.3896659364549 split increased to 2 itime 580432
+ acceleration/energy drift too large 6.54840608785262
+ 13.9759503442289 split increased to 2 itime 571056
itsplit 1
- acceleration/energy drift too large 3.41820888656590
- 26.1116834284304 split increased to 2 itime 580849
+ acceleration/energy drift too large 2.80492652769202
+ 12.3897453587319 split increased to 2 itime 574135
itsplit 1
- acceleration/energy drift too large 5.14458270353948
- 34.3642167393162 split increased to 2 itime 581943
+ acceleration/energy drift too large 7.95827299688954
+ 27.0970890315635 split increased to 2 itime 574629
itsplit 1
- acceleration/energy drift too large 4.90600604587959
- 32.4464514126978 split increased to 2 itime 583317
+ acceleration/energy drift too large 4.58484924675718
+ 10.2462644251674 split increased to 2 itime 575745
itsplit 1
- acceleration/energy drift too large 6.65296034490271
- 15.0961602600649 split increased to 2 itime 583699
+ acceleration/energy drift too large 2.25332404536768
+ 12.8302912384764 split increased to 2 itime 577521
itsplit 1
- acceleration/energy drift too large 6.57457922976373
- 13.4640735150194 split increased to 2 itime 584021
+ acceleration/energy drift too large 10.4563882258878
+ 69.0682147756401 split increased to 2 itime 577843
itsplit 1
- acceleration/energy drift too large 3.56987537864550
- 10.1330415993246 split increased to 2 itime 584406
+Velocities reset to random values, time 115999.80
+ acceleration/energy drift too large 2.94382091468212
+ 15.2183446455799 split increased to 2 itime 587079
itsplit 1
- acceleration/energy drift too large 4.88552779689805
- 19.8088871890450 split increased to 2 itime 584812
+ acceleration/energy drift too large 9.72831816375565
+ 40.5767003244547 split increased to 2 itime 588820
itsplit 1
- acceleration/energy drift too large 5.83075372970270
- 16.9227659906254 split increased to 2 itime 587573
+ acceleration/energy drift too large 5.29814542992048
+ 16.3104778243298 split increased to 2 itime 588879
itsplit 1
- acceleration/energy drift too large 13.1778968169276
- 73.5571946789578 split increased to 2 itime 589169
+ acceleration/energy drift too large 4.86769954611960
+ 33.4984288460723 split increased to 2 itime 589038
itsplit 1
- acceleration/energy drift too large 6.50616864134724
- 21.0998129265571 split increased to 2 itime 589630
+ acceleration/energy drift too large 1.48259598710568
+ 11.5791942939149 split increased to 2 itime 589160
itsplit 1
- acceleration/energy drift too large 5.39713503574611
- 14.8319054963819 split increased to 2 itime 589900
+ acceleration/energy drift too large 5.99904653062700
+ 42.6177655926637 split increased to 2 itime 589366
itsplit 1
Velocities reset to random values, time 117999.80
- acceleration/energy drift too large 9.01168976147967
- 27.1161604695109 split increased to 2 itime 591096
- itsplit 1
- acceleration/energy drift too large 4.83160333108601
- 13.9773223246657 split increased to 2 itime 592353
+ acceleration/energy drift too large 2.53215878853365
+ 10.7678049460087 split increased to 2 itime 591046
itsplit 1
- acceleration/energy drift too large 4.76209370814736
- 11.5022939522272 split increased to 2 itime 593561
+ acceleration/energy drift too large 6.04885358313373
+ 16.3385215728903 split increased to 2 itime 594530
itsplit 1
- acceleration/energy drift too large 6.11807636921755
- 13.7212306054072 split increased to 2 itime 596686
+ acceleration/energy drift too large 3.21143097147966
+ 17.4828366698872 split increased to 2 itime 595187
itsplit 1
- acceleration/energy drift too large 6.78895961337294
- 11.4897414315954 split increased to 2 itime 598478
+ acceleration/energy drift too large 5.82613753161231
+ 14.5700923952942 split increased to 2 itime 596338
itsplit 1
- acceleration/energy drift too large 4.12692973924663
- 15.2879214505011 split increased to 2 itime 598751
+ acceleration/energy drift too large 8.09167763309047
+ 30.6607984676892 split increased to 2 itime 597454
itsplit 1
- acceleration/energy drift too large 5.99453570163047
- 15.5054024061990 split increased to 2 itime 599208
+ acceleration/energy drift too large 5.06490467569374
+ 15.1352963669831 split increased to 2 itime 597655
itsplit 1
- acceleration/energy drift too large 4.23273541452622
- 11.0888322396737 split increased to 2 itime 599497
+ acceleration/energy drift too large 5.95798811350407
+ 13.7152227253521 split increased to 2 itime 599854
itsplit 1
Velocities reset to random values, time 119999.80
REMD synchro at 600000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 195.035156250000 0.000000000000000E+000
+ REMD gather times= 246.597656250000 0.000000000000000E+000
REMD writing rst time= 3.906250000000000E-003
- REMD writing traj time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
NREP 16
-ACC 1 250.00000 0.33333 6
-ACC 2 260.00000 0.33333 6
-ACC 3 270.00000 0.16667 6
-ACC 4 280.00000 0.50000 6
-ACC 5 290.00000 0.33333 6
-ACC 6 300.00000 0.66667 6
-ACC 7 310.00000 0.83333 6
-ACC 8 320.00000 0.50000 6
-ACC 9 330.00000 0.50000 6
-ACC 10 340.00000 0.50000 6
+ACC 1 250.00000 0.66667 6
+ACC 2 260.00000 0.16667 6
+ACC 3 270.00000 0.66667 6
+ACC 4 280.00000 0.33333 6
+ACC 5 290.00000 0.83333 6
+ACC 6 300.00000 0.50000 6
+ACC 7 310.00000 0.50000 6
+ACC 8 320.00000 0.66667 6
+ACC 9 330.00000 0.66667 6
+ACC 10 340.00000 0.66667 6
ACC 11 350.00000 0.66667 6
ACC 12 360.00000 1.00000 6
-ACC 13 370.00000 1.00000 6
-ACC 14 380.00000 0.83333 6
-ACC 15 390.00000 1.00000 6
+ACC 13 370.00000 0.83333 6
+ACC 14 380.00000 1.00000 6
+ACC 15 390.00000 0.83333 6
REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 1.61383574334184
- 10.8703549407332 split increased to 2 itime 601915
- itsplit 1
- acceleration/energy drift too large 4.13090095140610
- 11.1305416623764 split increased to 2 itime 602078
- itsplit 1
- acceleration/energy drift too large 6.73220659860410
- 21.3521154167369 split increased to 2 itime 602202
+ REMD exchange time= 7.812500000000000E-003
+ acceleration/energy drift too large 9.71715874518612
+ 59.8032874173844 split increased to 2 itime 607171
itsplit 1
- acceleration/energy drift too large 5.38228354580940
- 19.3628689561513 split increased to 2 itime 603678
+ acceleration/energy drift too large 4.40624250666789
+ 12.4735464516614 split increased to 2 itime 608452
itsplit 1
- acceleration/energy drift too large 12.0334931851951
- 61.0736639252352 split increased to 2 itime 603869
+ acceleration/energy drift too large 4.92471626019456
+ 12.8749967985790 split increased to 2 itime 608619
itsplit 1
- acceleration/energy drift too large 4.76702234139221
- 26.4461505089406 split increased to 2 itime 608849
+ acceleration/energy drift too large 2.92638293351378
+ 17.2687629694548 split increased to 2 itime 608847
itsplit 1
Velocities reset to random values, time 121999.80
- acceleration/energy drift too large 4.44511623156298
- 13.9800721172987 split increased to 2 itime 611747
- itsplit 1
- acceleration/energy drift too large 4.43930572794680
- 10.9546113602159 split increased to 2 itime 612900
- itsplit 1
- acceleration/energy drift too large 3.51213287547324
- 12.0562978140125 split increased to 2 itime 613121
- itsplit 1
- acceleration/energy drift too large 6.74574712483426
- 16.9322722223233 split increased to 2 itime 614592
- itsplit 1
- acceleration/energy drift too large 5.72135799384483
- 11.5086267252639 split increased to 2 itime 615757
+ acceleration/energy drift too large 6.76222420680634
+ 20.4787665723596 split increased to 2 itime 610526
itsplit 1
- acceleration/energy drift too large 4.35859024009647
- 16.1479363475983 split increased to 2 itime 616392
+ acceleration/energy drift too large 5.35938999590726
+ 15.7494533417325 split increased to 2 itime 611332
itsplit 1
- acceleration/energy drift too large 6.51414848632314
- 15.3633918217191 split increased to 2 itime 616472
+ acceleration/energy drift too large 5.33524414069573
+ 10.9140893048528 split increased to 2 itime 612114
itsplit 1
- acceleration/energy drift too large 7.11915115050323
- 22.1696102637861 split increased to 2 itime 616980
+ acceleration/energy drift too large 2.85977337754126
+ 17.0767507163904 split increased to 2 itime 612265
itsplit 1
- acceleration/energy drift too large 3.31043475223815
- 14.0103772875270 split increased to 2 itime 616981
+ acceleration/energy drift too large 3.01761334880526
+ 11.9009045695825 split increased to 2 itime 615109
itsplit 1
- acceleration/energy drift too large 4.60502470883819
- 17.7599431582187 split increased to 2 itime 618292
- itsplit 1
- acceleration/energy drift too large 6.41163644570835
- 27.0074964569075 split increased to 2 itime 618484
- itsplit 1
- acceleration/energy drift too large 4.25516281210151
- 14.1364883572687 split increased to 2 itime 619672
+ acceleration/energy drift too large 5.76895029471224
+ 14.0020953103614 split increased to 2 itime 616290
itsplit 1
Velocities reset to random values, time 123999.80
- acceleration/energy drift too large 3.41552147289797
- 12.8946933921410 split increased to 2 itime 621264
- itsplit 1
- acceleration/energy drift too large 7.22597558509700
- 21.6260265947815 split increased to 2 itime 621939
+ acceleration/energy drift too large 5.00627731892210
+ 15.9344036924909 split increased to 2 itime 620150
itsplit 1
- acceleration/energy drift too large 3.32210603761968
- 11.2519363752802 split increased to 2 itime 623160
+ acceleration/energy drift too large 5.30241147190562
+ 11.3698028078059 split increased to 2 itime 621072
itsplit 1
- acceleration/energy drift too large 4.01434930775965
- 18.9902504838354 split increased to 2 itime 624165
+ acceleration/energy drift too large 12.7833135883039
+ 67.1337457993802 split increased to 2 itime 621304
itsplit 1
- acceleration/energy drift too large 3.37203456399538
- 18.3126888666996 split increased to 2 itime 624914
- itsplit 1
- acceleration/energy drift too large 8.95316826923174
- 37.8843278140647 split increased to 2 itime 627818
- itsplit 1
-Velocities reset to random values, time 125999.80
- acceleration/energy drift too large 10.3379023004573
- 45.9783221038344 split increased to 2 itime 631622
- itsplit 1
- acceleration/energy drift too large 2.70572625910498
- 11.9806694593834 split increased to 4 itime 631622
+ acceleration/energy drift too large 2.32973725771269
+ 10.2049498086886 split increased to 4 itime 621304
itsplit 2
- acceleration/energy drift too large 7.38833473732745
- 23.1465144946963 split increased to 2 itime 632492
- itsplit 1
- acceleration/energy drift too large 2.90133796402800
- 10.2906197866190 split increased to 2 itime 632661
+ acceleration/energy drift too large 3.29420355352208
+ 12.3258359780711 split increased to 2 itime 622091
itsplit 1
- acceleration/energy drift too large 6.07300016531791
- 11.8798780638794 split increased to 2 itime 634219
+ acceleration/energy drift too large 5.71930806506670
+ 15.7387058099748 split increased to 2 itime 623030
itsplit 1
- acceleration/energy drift too large 1.75790944113087
- 10.2202055527658 split increased to 2 itime 637515
+ acceleration/energy drift too large 6.15119168429779
+ 17.2693746264671 split increased to 2 itime 624095
itsplit 1
- acceleration/energy drift too large 5.91197094579359
- 27.0840891531874 split increased to 2 itime 638799
+ acceleration/energy drift too large 4.93999527772330
+ 13.3315197418524 split increased to 2 itime 625495
itsplit 1
- acceleration/energy drift too large 5.37636385990829
- 13.8509445515420 split increased to 2 itime 639464
+ acceleration/energy drift too large 4.60198952011376
+ 15.9485900764603 split increased to 2 itime 625821
itsplit 1
-Velocities reset to random values, time 127999.80
- acceleration/energy drift too large 6.29067827563317
- 24.7435043157680 split increased to 2 itime 640033
+ acceleration/energy drift too large 12.0556188261804
+ 69.8860709807945 split increased to 2 itime 626286
itsplit 1
- acceleration/energy drift too large 4.45349336807577
- 11.8027979354510 split increased to 2 itime 640551
+ acceleration/energy drift too large 6.27665329714280
+ 26.6759763933355 split increased to 2 itime 627929
itsplit 1
- acceleration/energy drift too large 5.99693024591215
- 17.6223487934020 split increased to 2 itime 641881
+ acceleration/energy drift too large 5.16841085528000
+ 25.5642572830610 split increased to 2 itime 628484
itsplit 1
- acceleration/energy drift too large 5.75123438901773
- 15.5573152573780 split increased to 2 itime 642826
+ acceleration/energy drift too large 5.50937764328620
+ 19.4157357197023 split increased to 2 itime 628606
itsplit 1
- acceleration/energy drift too large 2.69926910764448
- 10.3392180444648 split increased to 2 itime 642922
+ acceleration/energy drift too large 3.05591740403203
+ 24.4386443236678 split increased to 2 itime 629539
itsplit 1
- acceleration/energy drift too large 4.49392739045279
- 29.4366097203193 split increased to 2 itime 642995
+ acceleration/energy drift too large 2.76462414439163
+ 10.4596700568920 split increased to 2 itime 629713
itsplit 1
- acceleration/energy drift too large 3.16721991791287
- 11.1410140085252 split increased to 2 itime 643016
+Velocities reset to random values, time 125999.80
+ acceleration/energy drift too large 5.04120310602140
+ 12.6078173736158 split increased to 2 itime 631644
itsplit 1
- acceleration/energy drift too large 2.47282930351708
- 10.6233173102080 split increased to 2 itime 643028
+ acceleration/energy drift too large 2.39949902546027
+ 17.0504778937893 split increased to 2 itime 632769
itsplit 1
- acceleration/energy drift too large 2.62115225978156
- 10.9304599449762 split increased to 2 itime 643060
+ acceleration/energy drift too large 3.34177919588478
+ 28.0613572847578 split increased to 2 itime 635478
itsplit 1
- acceleration/energy drift too large 6.10173235570320
- 12.7519050632937 split increased to 2 itime 645166
+ acceleration/energy drift too large 5.39761527381098
+ 18.3093460100015 split increased to 2 itime 636093
itsplit 1
- acceleration/energy drift too large 1.70767457692884
- 10.2461804222472 split increased to 2 itime 645553
+ acceleration/energy drift too large 4.54932031628597
+ 13.8642384182678 split increased to 2 itime 639646
itsplit 1
- acceleration/energy drift too large 2.62147763356911
- 10.6693131113800 split increased to 2 itime 645584
+Velocities reset to random values, time 127999.80
+ acceleration/energy drift too large 6.91273824347971
+ 35.1469077072675 split increased to 2 itime 640532
itsplit 1
- acceleration/energy drift too large 3.28611972242092
- 10.8060499568916 split increased to 2 itime 645594
+ acceleration/energy drift too large 2.65603008549948
+ 13.4475672506537 split increased to 2 itime 642883
itsplit 1
- acceleration/energy drift too large 3.04980893856563
- 15.0518134298067 split increased to 2 itime 645595
+ acceleration/energy drift too large 4.39385041471738
+ 11.0331370806649 split increased to 2 itime 645983
itsplit 1
- acceleration/energy drift too large 4.08482546857459
- 16.6776685314898 split increased to 2 itime 647400
+ acceleration/energy drift too large 7.11392505819986
+ 21.3984211886317 split increased to 2 itime 647683
itsplit 1
- acceleration/energy drift too large 6.74064000101903
- 18.7386337247554 split increased to 2 itime 647449
+ acceleration/energy drift too large 2.59892604791826
+ 10.7126511335512 split increased to 2 itime 649346
itsplit 1
- acceleration/energy drift too large 7.24494145620149
- 24.0197299659072 split increased to 2 itime 648336
+ acceleration/energy drift too large 8.43553973350020
+ 37.9038255467908 split increased to 2 itime 649675
itsplit 1
- acceleration/energy drift too large 6.37578608765211
- 14.1170294530328 split increased to 2 itime 649172
+ acceleration/energy drift too large 2.30066816759875
+ 27.7993441832080 split increased to 2 itime 649676
itsplit 1
Velocities reset to random values, time 129999.80
- acceleration/energy drift too large 7.05603828445552
- 13.0816390658427 split increased to 2 itime 653429
+ acceleration/energy drift too large 3.83954662955577
+ 10.5153298841480 split increased to 2 itime 651801
itsplit 1
- acceleration/energy drift too large 6.75793990386597
- 14.1884845126677 split increased to 2 itime 653479
+ acceleration/energy drift too large 3.76427566550022
+ 10.9121844353233 split increased to 2 itime 652185
itsplit 1
- acceleration/energy drift too large 8.27310550670955
- 17.6617784907215 split increased to 2 itime 654646
+ acceleration/energy drift too large 2.86185143034784
+ 20.4232202744548 split increased to 2 itime 652275
itsplit 1
- acceleration/energy drift too large 5.05637649327615
- 12.0506782209388 split increased to 2 itime 655164
+ acceleration/energy drift too large 4.29396444820257
+ 10.1068911404815 split increased to 2 itime 654113
itsplit 1
- acceleration/energy drift too large 7.76722876060624
- 21.3713041337327 split increased to 2 itime 655982
+ acceleration/energy drift too large 5.76822631513329
+ 25.6356596718263 split increased to 2 itime 655791
itsplit 1
- acceleration/energy drift too large 2.11558271992769
- 10.9135824522643 split increased to 2 itime 656624
+ acceleration/energy drift too large 1.92256810542904
+ 17.0238302079479 split increased to 2 itime 655792
itsplit 1
- acceleration/energy drift too large 5.63841662647707
- 12.6340853812411 split increased to 2 itime 657227
+ acceleration/energy drift too large 3.90414522769411
+ 13.6878200408195 split increased to 2 itime 657293
itsplit 1
-Velocities reset to random values, time 131999.80
- acceleration/energy drift too large 7.10981221770267
- 10.6719660492955 split increased to 2 itime 660687
+ acceleration/energy drift too large 4.73886927221301
+ 22.3124043189652 split increased to 2 itime 658104
itsplit 1
- acceleration/energy drift too large 5.25255662550628
- 10.4791949685477 split increased to 2 itime 661942
+ acceleration/energy drift too large 5.61217960662995
+ 20.8143472632252 split increased to 2 itime 659317
itsplit 1
- acceleration/energy drift too large 4.90670554098452
- 14.8997497934871 split increased to 2 itime 662623
+ acceleration/energy drift too large 5.27624729087840
+ 11.3642346101039 split increased to 2 itime 659927
itsplit 1
- acceleration/energy drift too large 6.65732779979351
- 16.6644131896240 split increased to 2 itime 663198
+Velocities reset to random values, time 131999.80
+ acceleration/energy drift too large 7.27138544505715
+ 22.0522021734202 split increased to 2 itime 661344
itsplit 1
- acceleration/energy drift too large 5.22191922386254
- 11.2544790171099 split increased to 2 itime 663577
+ acceleration/energy drift too large 6.76997060492267
+ 18.7689454989263 split increased to 2 itime 663264
itsplit 1
- acceleration/energy drift too large 2.51332347644796
- 10.4001107014571 split increased to 2 itime 665119
+ acceleration/energy drift too large 1.89498881590130
+ 11.6924984697133 split increased to 2 itime 663265
itsplit 1
- acceleration/energy drift too large 2.43833879666690
- 13.8247967054443 split increased to 2 itime 669735
+ acceleration/energy drift too large 4.71012071753865
+ 24.7361124863986 split increased to 2 itime 665990
itsplit 1
-Velocities reset to random values, time 133999.80
- acceleration/energy drift too large 5.96793203464628
- 14.4827336571532 split increased to 2 itime 671289
+ acceleration/energy drift too large 4.25256813735382
+ 16.7266556658472 split increased to 2 itime 668575
itsplit 1
- acceleration/energy drift too large 5.71587947456280
- 14.7745597113328 split increased to 2 itime 672408
+Velocities reset to random values, time 133999.80
+ acceleration/energy drift too large 2.97028645724151
+ 15.4115514672812 split increased to 2 itime 670170
itsplit 1
- acceleration/energy drift too large 5.48497438921223
- 12.1568427051958 split increased to 2 itime 676680
+ acceleration/energy drift too large 4.71276635535120
+ 13.9001211104302 split increased to 2 itime 670546
itsplit 1
- acceleration/energy drift too large 2.15692391202057
- 10.7919052767619 split increased to 2 itime 677075
+ acceleration/energy drift too large 4.05665159859389
+ 13.6518927915944 split increased to 2 itime 670791
itsplit 1
- acceleration/energy drift too large 5.32841318713589
- 18.0599331053517 split increased to 2 itime 678075
+ acceleration/energy drift too large 4.81382067786864
+ 10.7371078384639 split increased to 2 itime 671360
itsplit 1
- acceleration/energy drift too large 10.4983782829775
- 57.2214990313819 split increased to 2 itime 678749
+ acceleration/energy drift too large 2.35211449692875
+ 16.1371186919273 split increased to 2 itime 674269
itsplit 1
- acceleration/energy drift too large 6.75292451703138
- 13.8930163231851 split increased to 2 itime 678894
+ acceleration/energy drift too large 3.45858212223954
+ 10.6453284092327 split increased to 2 itime 676102
itsplit 1
- acceleration/energy drift too large 2.59487793515253
- 12.3356631865565 split increased to 2 itime 678983
+ acceleration/energy drift too large 3.18069158781499
+ 10.5184494090905 split increased to 2 itime 677010
itsplit 1
- acceleration/energy drift too large 2.66464124140996
- 17.1202670755749 split increased to 2 itime 679490
+ acceleration/energy drift too large 8.27044292755897
+ 17.8680409062391 split increased to 2 itime 677100
itsplit 1
Velocities reset to random values, time 135999.80
- acceleration/energy drift too large 8.98112518027019
- 27.4521750157633 split increased to 2 itime 683676
- itsplit 1
- acceleration/energy drift too large 5.32368642990992
- 16.4878339869579 split increased to 2 itime 684357
- itsplit 1
- acceleration/energy drift too large 13.5157746278577
- 74.0054818361155 split increased to 2 itime 684621
+ acceleration/energy drift too large 3.81821696054580
+ 24.2526821441175 split increased to 2 itime 681744
itsplit 1
- acceleration/energy drift too large 3.11641451014671
- 15.3328965898951 split increased to 4 itime 684621
- itsplit 2
- acceleration/energy drift too large 3.83946781163305
- 10.1157683026041 split increased to 2 itime 684843
- itsplit 1
- acceleration/energy drift too large 7.37229988676769
- 20.9688926608233 split increased to 2 itime 685060
- itsplit 1
- acceleration/energy drift too large 6.05549116788822
- 12.4171605308774 split increased to 2 itime 686331
+ acceleration/energy drift too large 6.99061182290122
+ 24.7359107735812 split increased to 2 itime 684913
itsplit 1
- acceleration/energy drift too large 4.50860242713658
- 10.7451491400415 split increased to 2 itime 686855
+ acceleration/energy drift too large 3.98290241303336
+ 11.7275853703771 split increased to 2 itime 686533
itsplit 1
- acceleration/energy drift too large 7.67206357961921
- 21.9534349853498 split increased to 2 itime 687130
+ acceleration/energy drift too large 4.86885150597400
+ 15.2934903355320 split increased to 2 itime 686885
itsplit 1
- acceleration/energy drift too large 4.67960302617472
- 10.3945718470318 split increased to 2 itime 687406
+ acceleration/energy drift too large 4.71754649980239
+ 12.8462508471881 split increased to 2 itime 687700
itsplit 1
- acceleration/energy drift too large 5.37410928380272
- 16.5280981260831 split increased to 2 itime 687978
- itsplit 1
- acceleration/energy drift too large 6.58378268465171
- 32.4602177741036 split increased to 2 itime 688139
- itsplit 1
- acceleration/energy drift too large 10.5213741684151
- 51.3532308630975 split increased to 2 itime 688945
+ acceleration/energy drift too large 4.57767748221234
+ 11.0000678006552 split increased to 2 itime 688084
itsplit 1
Velocities reset to random values, time 137999.80
- acceleration/energy drift too large 7.15818315439346
- 14.7711098991745 split increased to 2 itime 690123
- itsplit 1
- acceleration/energy drift too large 5.13345826735310
- 12.9154423939417 split increased to 2 itime 690452
+ acceleration/energy drift too large 13.2997689068681
+ 94.4635984333734 split increased to 2 itime 692228
itsplit 1
- acceleration/energy drift too large 3.69828575920798
- 13.7984282146694 split increased to 2 itime 690759
+ acceleration/energy drift too large 8.77309310113610
+ 19.8602818129925 split increased to 2 itime 693015
itsplit 1
- acceleration/energy drift too large 12.9113759021292
- 57.1071362044076 split increased to 2 itime 690869
- itsplit 1
- acceleration/energy drift too large 4.03032808784480
- 10.1613099293257 split increased to 2 itime 692840
- itsplit 1
- acceleration/energy drift too large 2.66692454099747
- 18.1850064454467 split increased to 2 itime 694427
- itsplit 1
- acceleration/energy drift too large 5.85125477896762
- 16.9846206804245 split increased to 2 itime 696768
- itsplit 1
- acceleration/energy drift too large 8.86495403644284
- 30.0966871554674 split increased to 2 itime 697025
- itsplit 1
- acceleration/energy drift too large 5.57468537830864
- 20.3692042181053 split increased to 2 itime 697139
- itsplit 1
- acceleration/energy drift too large 4.46260172527485
- 12.2672786320640 split increased to 2 itime 697501
+ acceleration/energy drift too large 3.71047698450896
+ 21.9360083048692 split increased to 2 itime 694769
itsplit 1
Velocities reset to random values, time 139999.80
REMD synchro at 700000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 227.496093750000 0.000000000000000E+000
+ REMD gather times= 287.238281250000 0.000000000000000E+000
REMD writing rst time= 3.906250000000000E-003
REMD writing traj time= 3.906250000000000E-003
NREP 16
-ACC 1 250.00000 0.28571 7
-ACC 2 260.00000 0.28571 7
-ACC 3 270.00000 0.14286 7
-ACC 4 280.00000 0.57143 7
-ACC 5 290.00000 0.28571 7
-ACC 6 300.00000 0.71429 7
-ACC 7 310.00000 0.85714 7
-ACC 8 320.00000 0.42857 7
+ACC 1 250.00000 0.57143 7
+ACC 2 260.00000 0.14286 7
+ACC 3 270.00000 0.57143 7
+ACC 4 280.00000 0.42857 7
+ACC 5 290.00000 0.85714 7
+ACC 6 300.00000 0.42857 7
+ACC 7 310.00000 0.57143 7
+ACC 8 320.00000 0.57143 7
ACC 9 330.00000 0.57143 7
-ACC 10 340.00000 0.57143 7
+ACC 10 340.00000 0.71429 7
ACC 11 350.00000 0.71429 7
ACC 12 360.00000 1.00000 7
-ACC 13 370.00000 1.00000 7
-ACC 14 380.00000 0.71429 7
-ACC 15 390.00000 1.00000 7
+ACC 13 370.00000 0.85714 7
+ACC 14 380.00000 1.00000 7
+ACC 15 390.00000 0.71429 7
REMD scatter time= 0.000000000000000E+000
REMD exchange time= 7.812500000000000E-003
- acceleration/energy drift too large 9.48111853840265
- 37.3554901747500 split increased to 2 itime 700269
- itsplit 1
- acceleration/energy drift too large 5.92652634184808
- 15.1625569006554 split increased to 2 itime 700670
- itsplit 1
- acceleration/energy drift too large 5.79815268365684
- 15.3208988252801 split increased to 2 itime 701066
- itsplit 1
- acceleration/energy drift too large 6.06539827063121
- 10.0975632460788 split increased to 2 itime 701439
- itsplit 1
- acceleration/energy drift too large 4.41167682862143
- 11.2960213307414 split increased to 2 itime 708298
- itsplit 1
- acceleration/energy drift too large 5.83749424212255
- 14.4170464613483 split increased to 2 itime 708807
+ acceleration/energy drift too large 10.3778105513077
+ 45.5705698821442 split increased to 2 itime 700713
itsplit 1
-Velocities reset to random values, time 141999.80
- acceleration/energy drift too large 3.11628270111409
- 10.9421282167708 split increased to 2 itime 710015
- itsplit 1
- acceleration/energy drift too large 2.48428420081342
- 10.7218168860647 split increased to 2 itime 710021
- itsplit 1
- acceleration/energy drift too large 3.38403592328471
- 10.5988596696206 split increased to 2 itime 710023
- itsplit 1
- acceleration/energy drift too large 3.64632714394122
- 24.9674676452095 split increased to 2 itime 710024
- itsplit 1
- acceleration/energy drift too large 2.53849806155195
- 11.7576421358898 split increased to 2 itime 710026
- itsplit 1
- acceleration/energy drift too large 3.58350553417218
- 11.4437948159201 split increased to 2 itime 711659
+ acceleration/energy drift too large 7.27573280681885
+ 24.9773549123473 split increased to 2 itime 701689
itsplit 1
- acceleration/energy drift too large 2.32418304338524
- 12.0403672971422 split increased to 2 itime 711660
+ acceleration/energy drift too large 6.95000881352936
+ 21.0349886412081 split increased to 2 itime 703581
itsplit 1
- acceleration/energy drift too large 2.42805959448394
- 14.8632007111289 split increased to 2 itime 712797
+ acceleration/energy drift too large 5.69628876858718
+ 23.8161175695906 split increased to 2 itime 704264
itsplit 1
- acceleration/energy drift too large 5.68015846820261
- 11.2926593529828 split increased to 2 itime 713572
+ acceleration/energy drift too large 3.93928634771575
+ 10.1940724001607 split increased to 2 itime 704705
itsplit 1
- acceleration/energy drift too large 9.21396852521451
- 37.1458138780936 split increased to 2 itime 713787
+ acceleration/energy drift too large 6.27973560454849
+ 14.9305840329817 split increased to 2 itime 707585
itsplit 1
- acceleration/energy drift too large 0.106769918407327
- 22.8161695510620 split increased to 2 itime 713788
+ acceleration/energy drift too large 6.31623307196396
+ 19.7653590101662 split increased to 2 itime 707795
itsplit 1
- acceleration/energy drift too large 8.90049746501867
- 40.0440672197960 split increased to 2 itime 713944
+ acceleration/energy drift too large 5.64308742094512
+ 16.3528520241839 split increased to 2 itime 708635
itsplit 1
- acceleration/energy drift too large 4.41848576780768
- 11.8317790664630 split increased to 2 itime 713974
+ acceleration/energy drift too large 4.64674972802479
+ 18.9843998879432 split increased to 2 itime 709649
itsplit 1
- acceleration/energy drift too large 7.80451541812845
- 30.8602288486198 split increased to 2 itime 714514
- itsplit 1
- acceleration/energy drift too large 7.24656117993099
- 21.2015267390908 split increased to 2 itime 715696
+Velocities reset to random values, time 141999.80
+ acceleration/energy drift too large 9.57199415528501
+ 44.9230058722958 split increased to 2 itime 710918
itsplit 1
- acceleration/energy drift too large 4.29602244471840
- 12.4356127685082 split increased to 2 itime 716071
+ acceleration/energy drift too large 6.27829155238554
+ 20.2094809942395 split increased to 2 itime 712410
itsplit 1
- acceleration/energy drift too large 4.74158122281652
- 15.3361576590736 split increased to 2 itime 717477
+ acceleration/energy drift too large 4.94108339671913
+ 16.2454096534851 split increased to 2 itime 714916
itsplit 1
- acceleration/energy drift too large 7.24162757349097
- 24.4939566977319 split increased to 2 itime 717937
+ acceleration/energy drift too large 1.58139072088629
+ 11.3134504660929 split increased to 2 itime 717821
itsplit 1
- acceleration/energy drift too large 3.80194827027654
- 11.2278036453757 split increased to 2 itime 719828
+ acceleration/energy drift too large 5.62619364680017
+ 19.0758211139970 split increased to 2 itime 719701
itsplit 1
Velocities reset to random values, time 143999.80
- acceleration/energy drift too large 5.72782673065057
- 12.1612164922536 split increased to 2 itime 721340
- itsplit 1
- acceleration/energy drift too large 2.80136494818698
- 13.4546088191659 split increased to 2 itime 722273
+ acceleration/energy drift too large 8.90664511810799
+ 30.7245742938004 split increased to 2 itime 720639
itsplit 1
- acceleration/energy drift too large 5.21377529799895
- 16.4543503622877 split increased to 2 itime 722921
+ acceleration/energy drift too large 4.18101659782279
+ 14.5463771146216 split increased to 2 itime 721665
itsplit 1
- acceleration/energy drift too large 6.74337265247742
- 13.5768408818075 split increased to 2 itime 723012
+ acceleration/energy drift too large 6.31798074268771
+ 18.6648250851177 split increased to 2 itime 723347
itsplit 1
- acceleration/energy drift too large 7.06799873558812
- 13.1597107220358 split increased to 2 itime 723684
+ acceleration/energy drift too large 5.45922533867425
+ 12.5303171763889 split increased to 2 itime 724356
itsplit 1
- acceleration/energy drift too large 2.46886350127129
- 12.2605346794587 split increased to 2 itime 727665
+ acceleration/energy drift too large 3.66629266475106
+ 14.9568924600617 split increased to 2 itime 727915
itsplit 1
- acceleration/energy drift too large 2.74879152809633
- 16.6596768449764 split increased to 2 itime 728113
+ acceleration/energy drift too large 9.13010064304933
+ 37.8993733018647 split increased to 2 itime 728265
itsplit 1
- acceleration/energy drift too large 3.70222923334393
- 10.4206060728096 split increased to 2 itime 728578
- itsplit 1
- acceleration/energy drift too large 8.38697111084772
- 24.5520288677278 split increased to 2 itime 728653
- itsplit 1
- acceleration/energy drift too large 6.55300226654904
- 12.4839620131983 split increased to 2 itime 729798
+ acceleration/energy drift too large 5.32719379476917
+ 19.3222371399577 split increased to 2 itime 729233
itsplit 1
Velocities reset to random values, time 145999.80
- acceleration/energy drift too large 4.52688412267505
- 12.1778120722852 split increased to 2 itime 730127
- itsplit 1
- acceleration/energy drift too large 7.27002570163120
- 22.9496763352238 split increased to 2 itime 730293
+ acceleration/energy drift too large 7.21564885130355
+ 18.1218745084352 split increased to 2 itime 733183
itsplit 1
- acceleration/energy drift too large 5.80078824337604
- 24.1179240500528 split increased to 2 itime 731025
+ acceleration/energy drift too large 4.18084418088015
+ 11.0738642328025 split increased to 2 itime 733427
itsplit 1
- acceleration/energy drift too large 3.01841900597338
- 17.0827045480764 split increased to 2 itime 733316
+ acceleration/energy drift too large 5.87958189450254
+ 24.7461867274068 split increased to 2 itime 735277
itsplit 1
- acceleration/energy drift too large 3.83421158293151
- 10.6573951084954 split increased to 2 itime 733722
+ acceleration/energy drift too large 6.18748492772104
+ 14.9326830525905 split increased to 2 itime 735435
itsplit 1
- acceleration/energy drift too large 3.84568400644585
- 25.6246692571675 split increased to 2 itime 738162
+ acceleration/energy drift too large 6.83995181617502
+ 16.7581154678553 split increased to 2 itime 737989
itsplit 1
- acceleration/energy drift too large 9.65148432617272
- 22.9353514656327 split increased to 2 itime 738372
+ acceleration/energy drift too large 1.67490689483482
+ 10.7839989694902 split increased to 2 itime 737990
itsplit 1
- acceleration/energy drift too large 2.30351365362488
- 11.5766459543138 split increased to 2 itime 738373
- itsplit 1
- acceleration/energy drift too large 2.41568109968673
- 11.0806841100755 split increased to 2 itime 739768
- itsplit 1
- acceleration/energy drift too large 6.17649060267068
- 12.4134296819427 split increased to 2 itime 739869
+ acceleration/energy drift too large 6.79184559076221
+ 15.8180365298599 split increased to 2 itime 739398
itsplit 1
Velocities reset to random values, time 147999.80
- acceleration/energy drift too large 3.19419989383782
- 29.0491254496017 split increased to 2 itime 740275
- itsplit 1
- acceleration/energy drift too large 4.53932184219639
- 18.9125153316458 split increased to 2 itime 741257
+ acceleration/energy drift too large 3.30831403126013
+ 11.1859602450591 split increased to 2 itime 742022
itsplit 1
- acceleration/energy drift too large 6.66409989160522
- 15.7527220510082 split increased to 2 itime 742923
+ acceleration/energy drift too large 4.07888915912230
+ 13.2748829366573 split increased to 2 itime 742027
itsplit 1
- acceleration/energy drift too large 5.08549409274227
- 18.8842862760581 split increased to 2 itime 743152
+ acceleration/energy drift too large 5.72499011188089
+ 15.3263852424929 split increased to 2 itime 742738
itsplit 1
- acceleration/energy drift too large 2.83180760254276
- 12.1885186578404 split increased to 2 itime 743430
+ acceleration/energy drift too large 7.83185407579471
+ 19.4951971527134 split increased to 2 itime 743233
itsplit 1
- acceleration/energy drift too large 5.46420460685356
- 11.1275707592010 split increased to 2 itime 744439
- itsplit 1
- acceleration/energy drift too large 2.81758019912195
- 20.4492849189267 split increased to 2 itime 748415
- itsplit 1
- acceleration/energy drift too large 5.85048355646658
- 11.1839991700051 split increased to 2 itime 749296
+ acceleration/energy drift too large 6.52887497863429
+ 21.4564475249590 split increased to 2 itime 749310
itsplit 1
Velocities reset to random values, time 149999.80
- acceleration/energy drift too large 4.88684548539567
- 11.4767290070410 split increased to 2 itime 751536
- itsplit 1
- acceleration/energy drift too large 2.59072324024931
- 16.4373749369956 split increased to 2 itime 752066
+ acceleration/energy drift too large 4.94921375391011
+ 12.2242079505662 split increased to 2 itime 750276
itsplit 1
- acceleration/energy drift too large 7.35073203984059
- 33.7807795980702 split increased to 2 itime 754963
+ acceleration/energy drift too large 11.1679888745769
+ 62.0550631922757 split increased to 2 itime 752053
itsplit 1
- acceleration/energy drift too large 3.79253420111213
- 10.1516805137794 split increased to 2 itime 754964
+ acceleration/energy drift too large 4.89572586133282
+ 10.7894332258531 split increased to 2 itime 755735
itsplit 1
- acceleration/energy drift too large 6.33588535096383
- 18.1585955158809 split increased to 2 itime 755746
+ acceleration/energy drift too large 4.63367814375340
+ 16.0053753500892 split increased to 2 itime 755990
itsplit 1
- acceleration/energy drift too large 4.25126564387823
- 16.4272801868394 split increased to 2 itime 756601
+ acceleration/energy drift too large 6.70881450263157
+ 21.9401424860544 split increased to 2 itime 756758
itsplit 1
- acceleration/energy drift too large 3.99524059314491
- 12.2937256147512 split increased to 2 itime 757595
- itsplit 1
- acceleration/energy drift too large 2.31570157723142
- 10.3463154443897 split increased to 2 itime 757890
- itsplit 1
- acceleration/energy drift too large 7.07350324380949
- 22.9036457575273 split increased to 2 itime 758372
- itsplit 1
- acceleration/energy drift too large 6.92149712332671
- 18.7065658373756 split increased to 2 itime 759045
- itsplit 1
- acceleration/energy drift too large 3.75418468437547
- 11.2267907412702 split increased to 2 itime 759422
+ acceleration/energy drift too large 2.59574291918531
+ 15.1827344266691 split increased to 2 itime 757037
itsplit 1
Velocities reset to random values, time 151999.80
- acceleration/energy drift too large 6.55590958378466
- 19.4943107855686 split increased to 2 itime 760130
- itsplit 1
- acceleration/energy drift too large 4.96341022660263
- 10.4796238965439 split increased to 2 itime 760609
+ acceleration/energy drift too large 7.32034953554721
+ 19.8162048344026 split increased to 2 itime 760706
itsplit 1
- acceleration/energy drift too large 4.28685045772715
- 17.2542038365198 split increased to 2 itime 762225
+ acceleration/energy drift too large 7.48416048631258
+ 27.1719402067542 split increased to 2 itime 762342
itsplit 1
- acceleration/energy drift too large 4.79139054576949
- 21.1929841889114 split increased to 2 itime 762332
+ acceleration/energy drift too large 4.18588105437259
+ 15.4932857043460 split increased to 2 itime 762864
itsplit 1
- acceleration/energy drift too large 2.19567166863080
- 19.6078390539336 split increased to 2 itime 762442
+ acceleration/energy drift too large 6.54325795200421
+ 20.9453564287120 split increased to 2 itime 763167
itsplit 1
- acceleration/energy drift too large 4.15562192183137
- 12.4052280101841 split increased to 2 itime 763270
+ acceleration/energy drift too large 1.45408992370410
+ 10.6691353890354 split increased to 2 itime 763168
itsplit 1
- acceleration/energy drift too large 6.67800779274290
- 10.8542006922579 split increased to 2 itime 763739
+ acceleration/energy drift too large 2.82344793669962
+ 14.7804760111857 split increased to 2 itime 764078
itsplit 1
- acceleration/energy drift too large 5.48945576396763
- 12.8426320077445 split increased to 2 itime 764978
+ acceleration/energy drift too large 8.31820693210541
+ 33.9992073588097 split increased to 2 itime 766434
itsplit 1
- acceleration/energy drift too large 2.41550070219384
- 10.4457610483471 split increased to 2 itime 765126
- itsplit 1
- acceleration/energy drift too large 8.30488215313361
- 20.5712218028977 split increased to 2 itime 765938
- itsplit 1
- acceleration/energy drift too large 2.68655262335729
- 14.5031465966545 split increased to 2 itime 769068
- itsplit 1
- acceleration/energy drift too large 14.3202262639808
- 74.1945645100843 split increased to 2 itime 769149
- itsplit 1
- acceleration/energy drift too large 6.37265317434364
- 10.3835483532290 split increased to 2 itime 769812
- itsplit 1
- acceleration/energy drift too large 5.41705913040113
- 19.2727135608556 split increased to 2 itime 769936
+ acceleration/energy drift too large 2.96568614245952
+ 11.4882593662374 split increased to 2 itime 767142
itsplit 1
Velocities reset to random values, time 153999.80
- acceleration/energy drift too large 2.65338508012329
- 18.2283304069230 split increased to 2 itime 770664
- itsplit 1
- acceleration/energy drift too large 7.78750398107057
- 23.4268212675427 split increased to 2 itime 771560
+ acceleration/energy drift too large 6.97846234309328
+ 21.1599471495579 split increased to 2 itime 770104
itsplit 1
- acceleration/energy drift too large 4.02270381472729
- 11.5911587335225 split increased to 2 itime 771572
+ acceleration/energy drift too large 6.07186105990665
+ 17.0411709570779 split increased to 2 itime 772282
itsplit 1
- acceleration/energy drift too large 7.24443763098898
- 17.3157345279854 split increased to 2 itime 772444
+ acceleration/energy drift too large 4.13149609079361
+ 16.1542632063644 split increased to 2 itime 773044
itsplit 1
- acceleration/energy drift too large 3.62766204619302
- 23.3847550239658 split increased to 2 itime 773643
+ acceleration/energy drift too large 3.58024752183285
+ 10.9986196865224 split increased to 2 itime 774074
itsplit 1
- acceleration/energy drift too large 7.73110985048388
- 22.3274899589543 split increased to 2 itime 774180
+ acceleration/energy drift too large 4.65933869631464
+ 11.3020894912283 split increased to 2 itime 775762
itsplit 1
- acceleration/energy drift too large 1.81456262597225
- 10.2289470769982 split increased to 2 itime 774964
- itsplit 1
- acceleration/energy drift too large 4.77104751390150
- 24.4200863473633 split increased to 2 itime 777295
- itsplit 1
- acceleration/energy drift too large 8.23848280431424
- 16.7089880075257 split increased to 2 itime 778458
- itsplit 1
- acceleration/energy drift too large 1.96611316381944
- 13.3068889340193 split increased to 2 itime 779390
- itsplit 1
- acceleration/energy drift too large 2.68269098733308
- 15.4345310766816 split increased to 2 itime 779472
+ acceleration/energy drift too large 6.64324453541183
+ 23.8329909845452 split increased to 2 itime 777131
itsplit 1
Velocities reset to random values, time 155999.80
- acceleration/energy drift too large 6.08631073696335
- 14.1857149912418 split increased to 2 itime 781128
- itsplit 1
- acceleration/energy drift too large 7.64876551395536
- 28.2934275516627 split increased to 2 itime 781643
+ acceleration/energy drift too large 6.21725848487174
+ 25.5192016738765 split increased to 2 itime 781969
itsplit 1
- acceleration/energy drift too large 1.65150666469985
- 11.3058518352293 split increased to 2 itime 781644
+ acceleration/energy drift too large 5.28482788139553
+ 11.5832453886868 split increased to 2 itime 782431
itsplit 1
- acceleration/energy drift too large 3.19338093587230
- 15.8156283500549 split increased to 2 itime 781853
+ acceleration/energy drift too large 5.41197131488078
+ 20.5645222904982 split increased to 2 itime 785602
itsplit 1
- acceleration/energy drift too large 7.51814928754246
- 15.3942026491305 split increased to 2 itime 782057
+ acceleration/energy drift too large 4.21617607792446
+ 12.4151289744401 split increased to 2 itime 785662
itsplit 1
- acceleration/energy drift too large 11.1570385150250
- 52.8792077583558 split increased to 2 itime 784630
+ acceleration/energy drift too large 5.65334441539085
+ 19.8128836173558 split increased to 2 itime 785798
itsplit 1
- acceleration/energy drift too large 2.47711238145094
- 11.1275614329443 split increased to 4 itime 784630
- itsplit 2
- acceleration/energy drift too large 6.67988208791786
- 17.2248826171143 split increased to 2 itime 784857
+ acceleration/energy drift too large 6.83070723864076
+ 19.6384142278756 split increased to 2 itime 786290
itsplit 1
- acceleration/energy drift too large 6.57037342439842
- 14.0873436511116 split increased to 2 itime 784873
+ acceleration/energy drift too large 5.46846480378341
+ 13.6903747152896 split increased to 2 itime 786291
itsplit 1
- acceleration/energy drift too large 7.13770580416722
- 13.6481273516105 split increased to 2 itime 785792
+ acceleration/energy drift too large 13.0371271915984
+ 83.8643176917916 split increased to 2 itime 786459
itsplit 1
- acceleration/energy drift too large 4.41598008239338
- 14.7027053964525 split increased to 2 itime 786898
+ acceleration/energy drift too large 2.53750747410760
+ 13.1257901957793 split increased to 4 itime 786459
itsplit 1
- acceleration/energy drift too large 3.01778004354443
- 13.5268941264796 split increased to 2 itime 787024
+ acceleration/energy drift too large 5.05341198342882
+ 18.6910663504077 split increased to 2 itime 786526
itsplit 1
- acceleration/energy drift too large 3.82485347191422
- 15.2306172963860 split increased to 2 itime 787226
+ acceleration/energy drift too large 5.54498610041270
+ 10.1127896865556 split increased to 2 itime 788113
itsplit 1
- acceleration/energy drift too large 2.39817914582185
- 10.1074315975894 split increased to 2 itime 787317
+ acceleration/energy drift too large 2.90616231253841
+ 17.3750446284212 split increased to 2 itime 788363
itsplit 1
- acceleration/energy drift too large 6.27314072074063
- 18.3138941886135 split increased to 2 itime 788621
- itsplit 1
- acceleration/energy drift too large 4.99020487564879
- 12.5705552876649 split increased to 2 itime 788908
+ acceleration/energy drift too large 5.71484421940178
+ 14.9752755984658 split increased to 2 itime 788521
itsplit 1
Velocities reset to random values, time 157999.80
- acceleration/energy drift too large 11.1575314870851
- 50.4528009695359 split increased to 2 itime 792019
- itsplit 1
- acceleration/energy drift too large 9.19395571448687
- 43.3527902848097 split increased to 2 itime 793235
- itsplit 1
- acceleration/energy drift too large 9.62756534992418
- 47.5344506914747 split increased to 2 itime 793291
- itsplit 1
- acceleration/energy drift too large 3.76857428974905
- 13.8317456983157 split increased to 2 itime 793292
- itsplit 1
- acceleration/energy drift too large 2.99088901104746
- 14.5313187730571 split increased to 2 itime 793311
- itsplit 1
- acceleration/energy drift too large 5.62990680970384
- 11.0099656047654 split increased to 2 itime 794150
+ acceleration/energy drift too large 3.48438872244240
+ 11.0277705412612 split increased to 2 itime 791053
itsplit 1
- acceleration/energy drift too large 7.25147605047218
- 25.1558180331533 split increased to 2 itime 795221
+ acceleration/energy drift too large 7.28480866116712
+ 21.8225684294232 split increased to 2 itime 793001
itsplit 1
- acceleration/energy drift too large 12.8975509930814
- 68.4949057161906 split increased to 2 itime 795398
+ acceleration/energy drift too large 3.15715745140506
+ 17.8421191129000 split increased to 2 itime 793953
itsplit 1
- acceleration/energy drift too large 7.37688326608030
- 12.4732805985511 split increased to 2 itime 796169
+ acceleration/energy drift too large 3.15369662510729
+ 11.0968276137573 split increased to 2 itime 794883
itsplit 1
- acceleration/energy drift too large 3.04329912000243
- 16.4115087312489 split increased to 2 itime 798661
- itsplit 1
- acceleration/energy drift too large 7.21552859647106
- 19.8684592979951 split increased to 2 itime 799560
- itsplit 1
- acceleration/energy drift too large 7.13321694859787
- 13.1035511102310 split increased to 2 itime 799561
- itsplit 1
- acceleration/energy drift too large 2.53698696597176
- 13.2101962190522 split increased to 2 itime 799567
+ acceleration/energy drift too large 7.72057481913265
+ 24.8835100133885 split increased to 2 itime 798908
itsplit 1
Velocities reset to random values, time 159999.80
REMD synchro at 800000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 260.140625000000 0.000000000000000E+000
+ REMD gather times= 328.550781250000 0.000000000000000E+000
REMD writing rst time= 3.906250000000000E-003
- REMD writing traj time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
NREP 16
-ACC 1 250.00000 0.25000 8
-ACC 2 260.00000 0.25000 8
-ACC 3 270.00000 0.12500 8
-ACC 4 280.00000 0.50000 8
-ACC 5 290.00000 0.37500 8
-ACC 6 300.00000 0.75000 8
-ACC 7 310.00000 0.75000 8
-ACC 8 320.00000 0.50000 8
+ACC 1 250.00000 0.50000 8
+ACC 2 260.00000 0.12500 8
+ACC 3 270.00000 0.62500 8
+ACC 4 280.00000 0.37500 8
+ACC 5 290.00000 0.87500 8
+ACC 6 300.00000 0.50000 8
+ACC 7 310.00000 0.50000 8
+ACC 8 320.00000 0.62500 8
ACC 9 330.00000 0.62500 8
-ACC 10 340.00000 0.50000 8
+ACC 10 340.00000 0.75000 8
ACC 11 350.00000 0.62500 8
-ACC 12 360.00000 1.00000 8
-ACC 13 370.00000 1.00000 8
-ACC 14 380.00000 0.75000 8
-ACC 15 390.00000 1.00000 8
+ACC 12 360.00000 0.87500 8
+ACC 13 370.00000 0.87500 8
+ACC 14 380.00000 1.00000 8
+ACC 15 390.00000 0.62500 8
REMD scatter time= 0.000000000000000E+000
- REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 2.49560117263529
- 12.3356114331076 split increased to 2 itime 801393
- itsplit 1
- acceleration/energy drift too large 2.68666226977592
- 14.1073489053055 split increased to 2 itime 801780
- itsplit 1
- acceleration/energy drift too large 6.28195659361892
- 15.1347694948240 split increased to 2 itime 801913
- itsplit 1
- acceleration/energy drift too large 3.33990698870006
- 16.2959306575547 split increased to 2 itime 802690
- itsplit 1
- acceleration/energy drift too large 2.25603803205069
- 11.2759948540232 split increased to 2 itime 802784
+ REMD exchange time= 7.812500000000000E-003
+ acceleration/energy drift too large 3.38237005481425
+ 13.0177372503329 split increased to 2 itime 800382
itsplit 1
- acceleration/energy drift too large 6.06649723495989
- 27.1236674896159 split increased to 2 itime 803868
+ acceleration/energy drift too large 3.68687740502707
+ 13.1131661952979 split increased to 2 itime 800387
itsplit 1
- acceleration/energy drift too large 1.76184697869429
- 12.5354068521887 split increased to 2 itime 803869
+ acceleration/energy drift too large 6.62429806890289
+ 12.2670178116433 split increased to 2 itime 800938
itsplit 1
- acceleration/energy drift too large 13.7393612938053
- 105.314521051185 split increased to 2 itime 803954
+ acceleration/energy drift too large 6.00459371892473
+ 15.9760740580868 split increased to 2 itime 802758
itsplit 1
- acceleration/energy drift too large 6.39829920904918
- 29.7066707076645 split increased to 2 itime 805716
+ acceleration/energy drift too large 4.17606065745418
+ 10.2323470782529 split increased to 2 itime 803761
itsplit 1
- acceleration/energy drift too large 11.2809067376822
- 85.4809057346991 split increased to 2 itime 805965
+ acceleration/energy drift too large 7.14104757757157
+ 20.7982096617325 split increased to 2 itime 804047
itsplit 1
- acceleration/energy drift too large 5.16315098747571
- 14.6334255936545 split increased to 2 itime 807126
+ acceleration/energy drift too large 2.83314361087813
+ 12.8493895575084 split increased to 4 itime 804047
itsplit 1
- acceleration/energy drift too large 3.04202243189798
- 12.4034331407945 split increased to 2 itime 807813
+ acceleration/energy drift too large 3.33130572746387
+ 14.4036278564385 split increased to 2 itime 806263
itsplit 1
- acceleration/energy drift too large 4.61196912165306
- 10.9756846369713 split increased to 2 itime 807903
+ acceleration/energy drift too large 12.1916474879637
+ 56.5697056781182 split increased to 2 itime 807235
itsplit 1
- acceleration/energy drift too large 3.36725671702218
- 23.7278988386518 split increased to 2 itime 808414
+ acceleration/energy drift too large 6.24713930055895
+ 18.6589292216253 split increased to 2 itime 808243
itsplit 1
- acceleration/energy drift too large 6.36914601316082
- 14.6148477746338 split increased to 2 itime 808637
+ acceleration/energy drift too large 6.03295922073790
+ 40.7623276865984 split increased to 2 itime 808686
itsplit 1
- acceleration/energy drift too large 7.51700144675740
- 24.3778459328923 split increased to 2 itime 808807
+ acceleration/energy drift too large 3.76743568790769
+ 14.6040332829347 split increased to 2 itime 809142
itsplit 1
- acceleration/energy drift too large 8.15724043951756
- 18.2389594890401 split increased to 2 itime 808853
+ acceleration/energy drift too large 4.13754874438400
+ 18.2337725436080 split increased to 2 itime 809623
itsplit 1
Velocities reset to random values, time 161999.80
- acceleration/energy drift too large 5.05353758900526
- 19.9487190282516 split increased to 2 itime 811132
+ acceleration/energy drift too large 4.61915591810941
+ 15.2083008276129 split increased to 2 itime 812048
itsplit 1
- acceleration/energy drift too large 7.35131152245022
- 17.9190768090841 split increased to 2 itime 811189
+ acceleration/energy drift too large 6.67026259160006
+ 16.1113234821336 split increased to 2 itime 813913
itsplit 1
- acceleration/energy drift too large 13.6542022900821
- 82.5490042083586 split increased to 2 itime 811502
+ acceleration/energy drift too large 5.58387686436455
+ 34.9327419785173 split increased to 2 itime 815133
itsplit 1
- acceleration/energy drift too large 2.26127983181184
- 10.1351707382094 split increased to 4 itime 811502
+ acceleration/energy drift too large 4.08276807715154
+ 19.0777719391742 split increased to 2 itime 816262
itsplit 1
- acceleration/energy drift too large 6.75823790596674
- 22.1115011809634 split increased to 2 itime 811527
+ acceleration/energy drift too large 5.27950585884284
+ 24.6189440909066 split increased to 2 itime 816612
itsplit 1
- acceleration/energy drift too large 4.57592671062124
- 12.9823309068691 split increased to 2 itime 813233
+ acceleration/energy drift too large 6.81190392531213
+ 24.6797017641099 split increased to 2 itime 816866
itsplit 1
- acceleration/energy drift too large 2.68704486328404
- 10.5845754320962 split increased to 2 itime 813271
+ acceleration/energy drift too large 2.93320265977883
+ 21.3972634743811 split increased to 2 itime 817074
itsplit 1
- acceleration/energy drift too large 7.25552506712819
- 17.5386551937626 split increased to 2 itime 813935
+ acceleration/energy drift too large 7.48598917794396
+ 32.6082284070652 split increased to 2 itime 817318
itsplit 1
- acceleration/energy drift too large 3.11262022119854
- 15.4771516739353 split increased to 2 itime 815078
+ acceleration/energy drift too large 8.26129258186401
+ 30.6228226158735 split increased to 2 itime 817966
itsplit 1
- acceleration/energy drift too large 3.96177052316574
- 28.4677161427700 split increased to 2 itime 815140
+ acceleration/energy drift too large 4.77570704216971
+ 22.0248529530527 split increased to 2 itime 818008
itsplit 1
- acceleration/energy drift too large 6.77365741524387
- 16.9618594515644 split increased to 2 itime 815423
+ acceleration/energy drift too large 5.35228511113650
+ 15.6578021514609 split increased to 2 itime 818163
itsplit 1
- acceleration/energy drift too large 3.19900949442022
- 16.7634629858129 split increased to 2 itime 815531
+ acceleration/energy drift too large 4.46753689895765
+ 24.3214321902305 split increased to 2 itime 818329
itsplit 1
- acceleration/energy drift too large 3.15534061463786
- 19.3080814281077 split increased to 2 itime 816113
+ acceleration/energy drift too large 8.65704282458737
+ 35.8732029872120 split increased to 2 itime 819528
itsplit 1
- acceleration/energy drift too large 7.07815234606879
- 13.0414904280456 split increased to 2 itime 816231
+ acceleration/energy drift too large 5.78007710800197
+ 22.0861024992975 split increased to 2 itime 819529
itsplit 1
- acceleration/energy drift too large 2.98572674928343
- 11.1635088775362 split increased to 2 itime 817443
+ acceleration/energy drift too large 4.87823055857814
+ 29.8210517689087 split increased to 2 itime 819530
itsplit 1
- acceleration/energy drift too large 2.60950069719954
- 14.5344310367469 split increased to 2 itime 817948
- itsplit 1
- acceleration/energy drift too large 2.42349725705244
- 14.0851445323885 split increased to 2 itime 818227
- itsplit 1
- acceleration/energy drift too large 2.40447030645576
- 16.3534444057961 split increased to 2 itime 818291
+ acceleration/energy drift too large 5.74715504704695
+ 25.1059119223681 split increased to 2 itime 819900
itsplit 1
Velocities reset to random values, time 163999.80
- acceleration/energy drift too large 5.57678277880079
- 11.5930884940148 split increased to 2 itime 820239
- itsplit 1
- acceleration/energy drift too large 5.61006805655581
- 20.8062583513205 split increased to 2 itime 820972
+ acceleration/energy drift too large 7.76147643858833
+ 29.4585233985278 split increased to 2 itime 821760
itsplit 1
- acceleration/energy drift too large 5.42005527386467
- 20.2903746069282 split increased to 2 itime 821758
- itsplit 1
- acceleration/energy drift too large 3.45405024697185
- 10.6077908235409 split increased to 2 itime 829497
- itsplit 1
-Velocities reset to random values, time 165999.80
- acceleration/energy drift too large 8.00482423739271
- 26.3192330041714 split increased to 2 itime 830292
+ acceleration/energy drift too large 3.83798515116589
+ 13.2033374964672 split increased to 2 itime 821770
itsplit 1
- acceleration/energy drift too large 0.000000000000000E+000
- 13.5358175515058 split increased to 2 itime 830293
+ acceleration/energy drift too large 2.49919679902956
+ 14.0079057484298 split increased to 2 itime 822357
itsplit 1
- acceleration/energy drift too large 12.0501062965000
- 81.4965932294386 split increased to 2 itime 830648
+ acceleration/energy drift too large 5.82407528491353
+ 25.3257064881128 split increased to 2 itime 824671
itsplit 1
- acceleration/energy drift too large 2.31833787539216
- 10.5441231759565 split increased to 4 itime 830648
+ acceleration/energy drift too large 5.32627469315376
+ 27.4006405978295 split increased to 2 itime 825001
itsplit 1
- acceleration/energy drift too large 3.31284394493809
- 11.0974395059474 split increased to 2 itime 831492
+ acceleration/energy drift too large 2.33214372413994
+ 14.2912364737723 split increased to 2 itime 825739
itsplit 1
- acceleration/energy drift too large 3.63920673154793
- 10.0184548310538 split increased to 2 itime 832199
+ acceleration/energy drift too large 6.22466386010683
+ 17.9960686598819 split increased to 2 itime 826578
itsplit 1
- acceleration/energy drift too large 2.57965518295656
- 14.3993670495984 split increased to 2 itime 833330
+ acceleration/energy drift too large 5.40935382198015
+ 12.1564640761943 split increased to 2 itime 827613
itsplit 1
- acceleration/energy drift too large 2.07787389788803
- 13.3300445432331 split increased to 2 itime 835341
+ acceleration/energy drift too large 6.86826673909432
+ 29.2659566477914 split increased to 2 itime 827895
itsplit 1
- acceleration/energy drift too large 9.74331826026958
- 30.6450269273983 split increased to 2 itime 837863
+ acceleration/energy drift too large 1.84483561906871
+ 10.2687803467267 split increased to 2 itime 827906
itsplit 1
- acceleration/energy drift too large 4.99620808438900
- 12.7355827298097 split increased to 2 itime 838757
+ acceleration/energy drift too large 4.41335974905746
+ 13.2407898890004 split increased to 2 itime 828514
itsplit 1
- acceleration/energy drift too large 4.51809368883965
- 12.3987328136999 split increased to 2 itime 839247
+ acceleration/energy drift too large 3.02034561393073
+ 16.6338408090693 split increased to 2 itime 829946
itsplit 1
- acceleration/energy drift too large 5.52602123070095
- 14.0929294820262 split increased to 2 itime 839818
- itsplit 1
-Velocities reset to random values, time 167999.80
- acceleration/energy drift too large 6.13721917571532
- 10.9127412760628 split increased to 2 itime 840724
- itsplit 1
- acceleration/energy drift too large 2.19293850530273
- 13.3015380609607 split increased to 2 itime 841636
- itsplit 1
- acceleration/energy drift too large 3.51122324319924
- 11.5525059454894 split increased to 2 itime 841751
- itsplit 1
- acceleration/energy drift too large 8.99381323759562
- 26.5463884010055 split increased to 2 itime 841853
- itsplit 1
- acceleration/energy drift too large 6.14269464578919
- 17.2473991214217 split increased to 2 itime 842424
+Velocities reset to random values, time 165999.80
+ acceleration/energy drift too large 3.08452972545759
+ 10.5044340844618 split increased to 2 itime 830652
itsplit 1
- acceleration/energy drift too large 5.34783634740487
- 10.1598674632788 split increased to 2 itime 844168
+ acceleration/energy drift too large 4.25104832653793
+ 23.6020327369768 split increased to 2 itime 831232
itsplit 1
- acceleration/energy drift too large 12.7826562028498
- 69.5226157271955 split increased to 2 itime 844537
+ acceleration/energy drift too large 3.85856743565436
+ 17.0170700739114 split increased to 2 itime 831257
itsplit 1
- acceleration/energy drift too large 2.43764402148802
- 10.9300343302225 split increased to 4 itime 844537
- itsplit 2
- acceleration/energy drift too large 5.55946334607925
- 15.3345545672609 split increased to 2 itime 846078
+ acceleration/energy drift too large 5.83119008389862
+ 17.2210768793317 split increased to 2 itime 831821
itsplit 1
- acceleration/energy drift too large 2.46314605679691
- 10.3122251663836 split increased to 2 itime 846131
+ acceleration/energy drift too large 2.72811395369507
+ 12.2677516099127 split increased to 2 itime 832689
itsplit 1
- acceleration/energy drift too large 5.64913145729300
- 25.2146316283323 split increased to 2 itime 846287
+ acceleration/energy drift too large 6.59370874136313
+ 28.4885900900972 split increased to 2 itime 835818
itsplit 1
- acceleration/energy drift too large 1.89346153186027
- 12.2863749401481 split increased to 2 itime 847228
+ acceleration/energy drift too large 2.43937127054156
+ 15.7146173182305 split increased to 2 itime 836053
itsplit 1
- acceleration/energy drift too large 2.46105455798979
- 11.6410190704922 split increased to 2 itime 847229
+ acceleration/energy drift too large 6.92352713455002
+ 22.3954301350214 split increased to 2 itime 836152
itsplit 1
- acceleration/energy drift too large 3.13434246794972
- 18.7878722362838 split increased to 2 itime 847920
+ acceleration/energy drift too large 10.3377921290485
+ 65.7154067717737 split increased to 2 itime 836657
itsplit 1
-Velocities reset to random values, time 169999.80
- acceleration/energy drift too large 1.80665683133751
- 10.5079509668449 split increased to 2 itime 850025
+ acceleration/energy drift too large 6.19757696466051
+ 20.0374099530676 split increased to 2 itime 836994
itsplit 1
- acceleration/energy drift too large 3.02107980669774
- 10.1033804329793 split increased to 2 itime 850086
+ acceleration/energy drift too large 2.92297915921742
+ 10.2742942501505 split increased to 2 itime 838306
itsplit 1
- acceleration/energy drift too large 8.75749543216179
- 28.7155022072959 split increased to 2 itime 850329
+ acceleration/energy drift too large 2.40425053490664
+ 10.9015965976524 split increased to 2 itime 838561
itsplit 1
- acceleration/energy drift too large 2.85367858335283
- 14.4938205479602 split increased to 2 itime 851849
+ acceleration/energy drift too large 4.97086160917120
+ 12.5812660991000 split increased to 2 itime 839160
itsplit 1
- acceleration/energy drift too large 3.56805453760284
- 22.2771976078644 split increased to 2 itime 851925
+Velocities reset to random values, time 167999.80
+ acceleration/energy drift too large 4.42382407486215
+ 20.5996592580773 split increased to 2 itime 840102
itsplit 1
- acceleration/energy drift too large 7.28857114627885
- 15.4024829004875 split increased to 2 itime 852313
+ acceleration/energy drift too large 4.35570287778676
+ 12.7768539335291 split increased to 2 itime 840130
itsplit 1
- acceleration/energy drift too large 2.70678695026793
- 11.4999378146110 split increased to 2 itime 853037
+ acceleration/energy drift too large 11.9814639271485
+ 70.1879084920940 split increased to 2 itime 841497
itsplit 1
- acceleration/energy drift too large 5.53770782910775
- 16.7776317738034 split increased to 2 itime 853099
+ acceleration/energy drift too large 3.68225950799101
+ 15.1774100075725 split increased to 2 itime 842027
itsplit 1
- acceleration/energy drift too large 5.87758068250916
- 28.2471211020177 split increased to 2 itime 853219
+ acceleration/energy drift too large 5.52356101604260
+ 21.6925019980335 split increased to 2 itime 842475
itsplit 1
- acceleration/energy drift too large 2.93007082503758
- 10.7187393085427 split increased to 2 itime 853338
+ acceleration/energy drift too large 4.84176523358378
+ 20.1892075942597 split increased to 2 itime 843439
itsplit 1
- acceleration/energy drift too large 3.01268820383414
- 11.0407864892503 split increased to 2 itime 853376
+ acceleration/energy drift too large 4.34206175859455
+ 20.2417658406234 split increased to 2 itime 844110
itsplit 1
- acceleration/energy drift too large 2.80156496969548
- 10.4013249854363 split increased to 2 itime 853394
+ acceleration/energy drift too large 5.39278510422845
+ 11.7355225791856 split increased to 2 itime 847857
itsplit 1
- acceleration/energy drift too large 1.65122494094768
- 10.2113834343005 split increased to 2 itime 853403
+ acceleration/energy drift too large 9.32972240718352
+ 42.9981090151215 split increased to 2 itime 848216
itsplit 1
- acceleration/energy drift too large 7.44527484528177
- 13.7841385879957 split increased to 2 itime 853429
+ acceleration/energy drift too large 2.45326740453658
+ 10.4502112328651 split increased to 2 itime 848663
itsplit 1
- acceleration/energy drift too large 5.65629070818708
- 17.0458799462099 split increased to 2 itime 853439
+Velocities reset to random values, time 169999.80
+ acceleration/energy drift too large 4.01177317857258
+ 15.4009906152363 split increased to 2 itime 852663
itsplit 1
- acceleration/energy drift too large 3.03459155706405
- 10.2246636921157 split increased to 2 itime 853457
+ acceleration/energy drift too large 5.32832053515490
+ 12.1204317802878 split increased to 2 itime 852686
itsplit 1
- acceleration/energy drift too large 3.43975999929615
- 10.0735328082754 split increased to 2 itime 853465
+ acceleration/energy drift too large 3.98636743684713
+ 15.6031059097922 split increased to 2 itime 852761
itsplit 1
- acceleration/energy drift too large 5.95949565467637
- 10.6248777300233 split increased to 2 itime 853884
+ acceleration/energy drift too large 6.09133283299758
+ 19.8555633563983 split increased to 2 itime 854979
itsplit 1
- acceleration/energy drift too large 3.26235958616251
- 16.2382768100874 split increased to 2 itime 855866
+ acceleration/energy drift too large 3.29060199291763
+ 13.0109398182878 split increased to 2 itime 856327
itsplit 1
- acceleration/energy drift too large 3.25510265633719
- 10.1902083423158 split increased to 2 itime 859189
+ acceleration/energy drift too large 5.42684472176758
+ 15.2348467137553 split increased to 2 itime 857245
itsplit 1
- acceleration/energy drift too large 5.65513832043211
- 17.2685971855113 split increased to 2 itime 859699
+ acceleration/energy drift too large 6.58400124516784
+ 20.3796919761434 split increased to 2 itime 859603
itsplit 1
Velocities reset to random values, time 171999.80
- acceleration/energy drift too large 4.55273828947972
- 12.9405242204499 split increased to 2 itime 860026
+ acceleration/energy drift too large 4.80220914999480
+ 10.1339151576946 split increased to 2 itime 860051
itsplit 1
- acceleration/energy drift too large 4.03859991980701
- 17.6384616027247 split increased to 2 itime 860805
+ acceleration/energy drift too large 5.61406210317378
+ 13.1287090195770 split increased to 2 itime 862241
itsplit 1
- acceleration/energy drift too large 5.44533236395329
- 11.9900874412947 split increased to 2 itime 863611
+ acceleration/energy drift too large 8.68857308572128
+ 35.3468372891964 split increased to 2 itime 862544
itsplit 1
- acceleration/energy drift too large 8.41220129370948
- 27.6507273707973 split increased to 2 itime 866267
+ acceleration/energy drift too large 7.72016803392450
+ 34.0202217339789 split increased to 2 itime 863102
itsplit 1
- acceleration/energy drift too large 0.901120329823053
- 10.9070219855306 split increased to 2 itime 866934
+ acceleration/energy drift too large 4.46722802391829
+ 20.6389178636878 split increased to 2 itime 864411
itsplit 1
- acceleration/energy drift too large 4.97754816713980
- 28.8852847503531 split increased to 2 itime 867373
+ acceleration/energy drift too large 4.26167219403029
+ 17.7515715413730 split increased to 2 itime 865334
itsplit 1
-Velocities reset to random values, time 173999.80
- acceleration/energy drift too large 2.18828827910352
- 18.1507258758246 split increased to 2 itime 870319
+ acceleration/energy drift too large 4.22973432515897
+ 15.7119262696159 split increased to 2 itime 865360
itsplit 1
- acceleration/energy drift too large 6.46640532644212
- 17.8239652571664 split increased to 2 itime 870430
+ acceleration/energy drift too large 3.42514822772696
+ 28.5112804028908 split increased to 2 itime 865600
itsplit 1
- acceleration/energy drift too large 5.06817053721608
- 19.8416639824450 split increased to 2 itime 870780
+ acceleration/energy drift too large 7.56665436731381
+ 13.8427274354859 split increased to 2 itime 866445
itsplit 1
- acceleration/energy drift too large 8.92245620926862
- 44.0746396569052 split increased to 2 itime 871450
+ acceleration/energy drift too large 5.75578779139162
+ 16.2833218762952 split increased to 2 itime 866518
itsplit 1
- acceleration/energy drift too large 5.95504823482435
- 15.9788176144003 split increased to 2 itime 871749
+ acceleration/energy drift too large 14.1661847765509
+ 76.8908589401424 split increased to 2 itime 866547
itsplit 1
- acceleration/energy drift too large 4.77300230775419
- 36.2175623199170 split increased to 2 itime 872939
+ acceleration/energy drift too large 4.76568051040051
+ 17.5682634591496 split increased to 2 itime 866640
itsplit 1
- acceleration/energy drift too large 2.63602987384130
- 10.7759426883458 split increased to 2 itime 873242
+ acceleration/energy drift too large 3.61741601860296
+ 14.7319553745138 split increased to 2 itime 866664
itsplit 1
- acceleration/energy drift too large 5.65448353432216
- 24.8240118446221 split increased to 2 itime 873345
+ acceleration/energy drift too large 4.23149370106149
+ 11.2728063972302 split increased to 2 itime 867981
itsplit 1
- acceleration/energy drift too large 5.76813687672142
- 13.0981273794735 split increased to 2 itime 875134
+ acceleration/energy drift too large 4.37261015614908
+ 16.2752457006339 split increased to 2 itime 868277
itsplit 1
- acceleration/energy drift too large 6.98649268730153
- 27.0308322258294 split increased to 2 itime 875734
+ acceleration/energy drift too large 5.39311996656503
+ 14.8284667670240 split increased to 2 itime 868886
itsplit 1
- acceleration/energy drift too large 2.65805090178710
- 10.4209346179988 split increased to 2 itime 875735
+ acceleration/energy drift too large 6.42637114225298
+ 25.3752062598473 split increased to 2 itime 869480
itsplit 1
- acceleration/energy drift too large 7.17093022152299
- 53.0458430838626 split increased to 2 itime 875766
+ acceleration/energy drift too large 3.61218759810998
+ 10.1041583750837 split increased to 2 itime 869842
itsplit 1
- acceleration/energy drift too large 3.57869325422669
- 11.2243184077936 split increased to 2 itime 875835
+Velocities reset to random values, time 173999.80
+ acceleration/energy drift too large 5.26224574508002
+ 13.9609489980110 split increased to 2 itime 870684
itsplit 1
- acceleration/energy drift too large 4.25936442577975
- 16.4397413493135 split increased to 2 itime 875841
+ acceleration/energy drift too large 4.58902038030952
+ 15.1875174577019 split increased to 2 itime 873573
itsplit 1
- acceleration/energy drift too large 5.14059276487108
- 20.3488899269363 split increased to 2 itime 876135
+ acceleration/energy drift too large 13.9613658556561
+ 89.6770171184682 split increased to 2 itime 876474
itsplit 1
- acceleration/energy drift too large 5.49959218092088
- 10.7763260335624 split increased to 2 itime 877620
+ acceleration/energy drift too large 5.19745848633278
+ 13.5552548236322 split increased to 2 itime 876664
itsplit 1
- acceleration/energy drift too large 4.11430508825666
- 17.2593216404412 split increased to 2 itime 877960
+ acceleration/energy drift too large 7.21262992004234
+ 26.1162178372731 split increased to 2 itime 878940
itsplit 1
- acceleration/energy drift too large 1.96618270978794
- 10.7548500267240 split increased to 2 itime 878944
+ acceleration/energy drift too large 3.19181255264547
+ 26.8749444803355 split increased to 2 itime 879426
itsplit 1
Velocities reset to random values, time 175999.80
- acceleration/energy drift too large 4.50085696255361
- 17.1931603173068 split increased to 2 itime 880039
- itsplit 1
- acceleration/energy drift too large 5.07920195263373
- 20.5566095602744 split increased to 2 itime 880612
- itsplit 1
- acceleration/energy drift too large 2.14885614361353
- 12.1712072961552 split increased to 2 itime 880613
- itsplit 1
- acceleration/energy drift too large 4.09490233827386
- 13.2227447597963 split increased to 2 itime 881297
- itsplit 1
- acceleration/energy drift too large 2.76121466136139
- 12.4162432832061 split increased to 2 itime 888117
- itsplit 1
- acceleration/energy drift too large 5.09152574597872
- 10.2458406228725 split increased to 2 itime 888138
- itsplit 1
- acceleration/energy drift too large 7.02118940801007
- 10.5035774001151 split increased to 2 itime 888140
- itsplit 1
- acceleration/energy drift too large 4.54600941673804
- 13.9277090465177 split increased to 2 itime 888141
- itsplit 1
- acceleration/energy drift too large 4.04621132710032
- 11.0054131226153 split increased to 2 itime 888148
- itsplit 1
- acceleration/energy drift too large 5.71542332415581
- 10.8827154294570 split increased to 2 itime 888152
- itsplit 1
- acceleration/energy drift too large 5.75314403383777
- 10.5890996973347 split increased to 2 itime 888156
+ acceleration/energy drift too large 3.06977792748143
+ 10.9931982294421 split increased to 2 itime 880666
itsplit 1
- acceleration/energy drift too large 3.75198758194863
- 12.0991477593957 split increased to 2 itime 888164
+ acceleration/energy drift too large 2.75694849461784
+ 11.7667639269563 split increased to 2 itime 882687
itsplit 1
- acceleration/energy drift too large 4.98201572366295
- 10.3043516043652 split increased to 2 itime 888168
+ acceleration/energy drift too large 2.09375992110116
+ 12.8053419691018 split increased to 2 itime 882743
itsplit 1
- acceleration/energy drift too large 2.95268066476644
- 11.1474938133876 split increased to 2 itime 888180
+ acceleration/energy drift too large 7.06028544458109
+ 23.8162294557140 split increased to 2 itime 884464
itsplit 1
- acceleration/energy drift too large 5.12665800830734
- 11.7955945361376 split increased to 2 itime 888181
+ acceleration/energy drift too large 4.64639653219010
+ 17.7407870408273 split increased to 2 itime 884469
itsplit 1
- acceleration/energy drift too large 3.83618216349276
- 17.8826854046009 split increased to 2 itime 888920
+ acceleration/energy drift too large 7.70312672473051
+ 16.5990540034600 split increased to 2 itime 885812
itsplit 1
- acceleration/energy drift too large 5.72625734108303
- 16.5623128668462 split increased to 2 itime 889044
+ acceleration/energy drift too large 10.5966941671069
+ 56.4906800020849 split increased to 2 itime 887024
itsplit 1
- acceleration/energy drift too large 4.35445521093365
- 13.4739248517020 split increased to 2 itime 889335
+ acceleration/energy drift too large 4.52503097126906
+ 10.1162669551670 split increased to 2 itime 887317
itsplit 1
Velocities reset to random values, time 177999.80
- acceleration/energy drift too large 7.97081285029943
- 20.2934538235427 split increased to 2 itime 890899
+ acceleration/energy drift too large 8.69619961973597
+ 34.2998760748367 split increased to 2 itime 893460
itsplit 1
- acceleration/energy drift too large 14.1946885697873
- 79.8953940515239 split increased to 2 itime 890977
+ acceleration/energy drift too large 4.81374567429138
+ 21.4606246013860 split increased to 2 itime 894160
itsplit 1
- acceleration/energy drift too large 6.59195788304317
- 15.1725048027940 split increased to 2 itime 893493
+ acceleration/energy drift too large 6.40577581382601
+ 18.0537684065880 split increased to 2 itime 895597
itsplit 1
- acceleration/energy drift too large 3.61112281189922
- 23.1225582308175 split increased to 2 itime 894915
+ acceleration/energy drift too large 8.92645731056566
+ 41.9458186500683 split increased to 2 itime 896355
itsplit 1
- acceleration/energy drift too large 5.15346064609156
- 11.9135346954492 split increased to 2 itime 895700
- itsplit 1
- acceleration/energy drift too large 11.0643854172652
- 46.9783643057636 split increased to 2 itime 896457
- itsplit 1
- acceleration/energy drift too large 7.90367358684655
- 20.7030618150979 split increased to 2 itime 896573
- itsplit 1
- acceleration/energy drift too large 4.47835540551316
- 16.2728575005891 split increased to 2 itime 896672
- itsplit 1
- acceleration/energy drift too large 2.68342279807970
- 10.1776027311715 split increased to 2 itime 896923
- itsplit 1
- acceleration/energy drift too large 5.86776394986179
- 18.0743341443649 split increased to 2 itime 898063
+ acceleration/energy drift too large 7.61581689275868
+ 20.6076007994704 split increased to 2 itime 898012
itsplit 1
Velocities reset to random values, time 179999.80
REMD synchro at 900000
ntwx_cache 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
MIN ii_write= 1
- REMD gather times= 292.386718750000 0.000000000000000E+000
- REMD writing rst time= 3.906250000000000E-003
- REMD writing traj time= 0.000000000000000E+000
+ REMD gather times= 369.171875000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
NREP 16
-ACC 1 250.00000 0.22222 9
-ACC 2 260.00000 0.33333 9
-ACC 3 270.00000 0.11111 9
-ACC 4 280.00000 0.44444 9
-ACC 5 290.00000 0.44444 9
-ACC 6 300.00000 0.77778 9
-ACC 7 310.00000 0.66667 9
+ACC 1 250.00000 0.44444 9
+ACC 2 260.00000 0.11111 9
+ACC 3 270.00000 0.66667 9
+ACC 4 280.00000 0.33333 9
+ACC 5 290.00000 0.88889 9
+ACC 6 300.00000 0.55556 9
+ACC 7 310.00000 0.44444 9
ACC 8 320.00000 0.55556 9
-ACC 9 330.00000 0.66667 9
-ACC 10 340.00000 0.55556 9
-ACC 11 350.00000 0.66667 9
-ACC 12 360.00000 1.00000 9
-ACC 13 370.00000 1.00000 9
-ACC 14 380.00000 0.77778 9
-ACC 15 390.00000 1.00000 9
+ACC 9 330.00000 0.55556 9
+ACC 10 340.00000 0.77778 9
+ACC 11 350.00000 0.55556 9
+ACC 12 360.00000 0.88889 9
+ACC 13 370.00000 0.88889 9
+ACC 14 380.00000 1.00000 9
+ACC 15 390.00000 0.66667 9
REMD scatter time= 0.000000000000000E+000
REMD exchange time= 3.906250000000000E-003
- acceleration/energy drift too large 5.46795202394077
- 12.4053107604193 split increased to 2 itime 900433
- itsplit 1
- acceleration/energy drift too large 5.50109499622398
- 11.4962217826986 split increased to 2 itime 900968
- itsplit 1
- acceleration/energy drift too large 10.0442041840859
- 44.4184851121257 split increased to 2 itime 904487
+ acceleration/energy drift too large 8.05481103337943
+ 31.1250684426175 split increased to 2 itime 900965
itsplit 1
- acceleration/energy drift too large 7.67413303359464
- 18.9150313032399 split increased to 2 itime 904606
+ acceleration/energy drift too large 2.61701571818722
+ 11.2523407808492 split increased to 2 itime 901069
itsplit 1
- acceleration/energy drift too large 6.51226175435724
- 11.9513327865067 split increased to 2 itime 904973
+ acceleration/energy drift too large 5.02527464245620
+ 30.8075250634187 split increased to 2 itime 902459
itsplit 1
- acceleration/energy drift too large 6.66077199516070
- 25.5556665753005 split increased to 2 itime 907507
+ acceleration/energy drift too large 3.63754398330254
+ 13.0323950177681 split increased to 2 itime 905694
itsplit 1
- acceleration/energy drift too large 5.67642823651232
- 12.4686849709379 split increased to 2 itime 909063
+ acceleration/energy drift too large 5.15769862220467
+ 20.1188377501454 split increased to 2 itime 909430
itsplit 1
- acceleration/energy drift too large 5.18693284879895
- 14.5965583171698 split increased to 2 itime 909471
- itsplit 1
- acceleration/energy drift too large 5.47728232916030
- 10.8508838339532 split increased to 2 itime 909558
- itsplit 1
- acceleration/energy drift too large 9.85406291183883
- 42.8358522754478 split increased to 2 itime 909676
+ acceleration/energy drift too large 7.64897381808747
+ 43.5816957290465 split increased to 2 itime 909945
itsplit 1
Velocities reset to random values, time 181999.80
- acceleration/energy drift too large 6.30436371066556
- 30.0892844964180 split increased to 2 itime 910447
- itsplit 1
- acceleration/energy drift too large 5.73693858360652
- 11.7229739097340 split increased to 2 itime 911884
+ acceleration/energy drift too large 6.43965794544967
+ 19.4895452720833 split increased to 2 itime 915325
itsplit 1
- acceleration/energy drift too large 5.16232019272427
- 16.5271023396916 split increased to 2 itime 912425
+ acceleration/energy drift too large 3.57245023717684
+ 12.2804834660481 split increased to 2 itime 917812
itsplit 1
- acceleration/energy drift too large 7.35318443512268
- 24.4559052197462 split increased to 2 itime 913148
+ acceleration/energy drift too large 2.76618512052184
+ 16.0797115374640 split increased to 2 itime 918571
itsplit 1
- acceleration/energy drift too large 4.85116064547893
- 22.9025039623007 split increased to 2 itime 914518
+ acceleration/energy drift too large 3.93706142966390
+ 13.8735354497499 split increased to 2 itime 918967
itsplit 1
- acceleration/energy drift too large 4.70781399946207
- 11.3487926243905 split increased to 2 itime 915527
- itsplit 1
- acceleration/energy drift too large 6.63713898189145
- 18.7681723616435 split increased to 2 itime 919191
+ acceleration/energy drift too large 5.55311303360152
+ 10.7282234186528 split increased to 2 itime 919348
itsplit 1
Velocities reset to random values, time 183999.80
- acceleration/energy drift too large 3.10581594273183
- 10.8007075949841 split increased to 2 itime 920254
+ acceleration/energy drift too large 2.69169427088324
+ 11.0914612938132 split increased to 2 itime 920811
itsplit 1
- acceleration/energy drift too large 12.8789227743900
- 72.0207941837624 split increased to 2 itime 920479
+ acceleration/energy drift too large 6.22566156787866
+ 15.1582361098060 split increased to 2 itime 921276
itsplit 1
- acceleration/energy drift too large 5.56570722995958
- 12.0881812892180 split increased to 2 itime 920581
+ acceleration/energy drift too large 2.98890256972757
+ 11.1881202362247 split increased to 2 itime 921277
itsplit 1
- acceleration/energy drift too large 4.67246787522468
- 11.7478761321492 split increased to 2 itime 921108
+ acceleration/energy drift too large 5.27814141151621
+ 10.6341631584489 split increased to 2 itime 925823
itsplit 1
- acceleration/energy drift too large 5.51087434466140
- 35.7468755102351 split increased to 2 itime 921134
+ acceleration/energy drift too large 5.81284524109278
+ 24.5891252197165 split increased to 2 itime 927653
itsplit 1
- acceleration/energy drift too large 4.24961766761127
- 11.6203021960735 split increased to 2 itime 921167
+ acceleration/energy drift too large 5.48119060386932
+ 10.8480485065602 split increased to 2 itime 927898
itsplit 1
- acceleration/energy drift too large 4.65288297463304
- 14.8450931629441 split increased to 2 itime 922733
+ acceleration/energy drift too large 8.51979883796464
+ 42.4999980680505 split increased to 2 itime 928346
itsplit 1
- acceleration/energy drift too large 5.51132950579083
- 10.7816062217321 split increased to 2 itime 924729
+Velocities reset to random values, time 185999.80
+ acceleration/energy drift too large 4.80529118356420
+ 25.2031100504070 split increased to 2 itime 930834
itsplit 1
- acceleration/energy drift too large 4.45155983053948
- 29.7470128534273 split increased to 2 itime 925076
+ acceleration/energy drift too large 5.02860584553965
+ 12.7568458295912 split increased to 2 itime 931692
itsplit 1
- acceleration/energy drift too large 9.75664801627854
- 41.3883303482626 split increased to 2 itime 925972
+ acceleration/energy drift too large 4.89229708246707
+ 12.5377126475266 split increased to 2 itime 932447
itsplit 1
- acceleration/energy drift too large 4.33451815599813
- 12.5405886707434 split increased to 2 itime 926710
+ acceleration/energy drift too large 4.55470478641012
+ 12.4519867462869 split increased to 2 itime 934346
itsplit 1
- acceleration/energy drift too large 5.32582042388224
- 13.5872876149547 split increased to 2 itime 927327
+ acceleration/energy drift too large 4.69468097998586
+ 11.9087258610449 split increased to 2 itime 934689
itsplit 1
- acceleration/energy drift too large 6.39968685125883
- 14.5480442498535 split increased to 2 itime 927870
+ acceleration/energy drift too large 3.18264593449796
+ 11.0633353061993 split increased to 2 itime 934793
itsplit 1
- acceleration/energy drift too large 1.74141356534464
- 10.8669114056156 split increased to 2 itime 927886
+ acceleration/energy drift too large 4.53434968843685
+ 24.6277881599707 split increased to 2 itime 935343
itsplit 1
- acceleration/energy drift too large 4.94208842148299
- 18.0076923279581 split increased to 2 itime 929406
+ acceleration/energy drift too large 4.90733753505980
+ 10.5255027704337 split increased to 2 itime 935641
itsplit 1
- acceleration/energy drift too large 6.05714344097599
- 14.6650248944933 split increased to 2 itime 929785
+ acceleration/energy drift too large 2.75682345103759
+ 19.4700407057487 split increased to 2 itime 936307
itsplit 1
-Velocities reset to random values, time 185999.80
- acceleration/energy drift too large 5.56584724752194
- 10.8215121700184 split increased to 2 itime 930415
+ acceleration/energy drift too large 4.60486379485938
+ 10.2498467363683 split increased to 2 itime 936429
itsplit 1
- acceleration/energy drift too large 5.48624404901165
- 12.3240871251260 split increased to 2 itime 933700
+ acceleration/energy drift too large 5.79733375322079
+ 24.1610180437751 split increased to 2 itime 937093
itsplit 1
- acceleration/energy drift too large 5.06849934390924
- 11.3344859192855 split increased to 2 itime 935484
+ acceleration/energy drift too large 5.51725381536469
+ 32.0439873409124 split increased to 2 itime 937975
itsplit 1
- acceleration/energy drift too large 2.93636987546305
- 17.3638401539236 split increased to 2 itime 935833
- itsplit 1
- acceleration/energy drift too large 5.01506072770740
- 12.1987550948904 split increased to 2 itime 939464
+ acceleration/energy drift too large 6.51073858825441
+ 28.7804807643715 split increased to 2 itime 939602
itsplit 1
Velocities reset to random values, time 187999.80
- acceleration/energy drift too large 7.74618902670613
- 28.9633187201744 split increased to 2 itime 941504
- itsplit 1
- acceleration/energy drift too large 5.59782282452616
- 22.1916551891740 split increased to 2 itime 945233
+ acceleration/energy drift too large 4.69124760082540
+ 18.9492456626369 split increased to 2 itime 940209
itsplit 1
- acceleration/energy drift too large 4.50578472031163
- 11.9501961544706 split increased to 2 itime 946321
+ acceleration/energy drift too large 6.74917361811743
+ 26.4067228155295 split increased to 2 itime 940552
itsplit 1
- acceleration/energy drift too large 10.7277829490960
- 36.9073502823179 split increased to 2 itime 946994
+ acceleration/energy drift too large 2.30403830889995
+ 11.0353766604116 split increased to 2 itime 940553
itsplit 1
- acceleration/energy drift too large 6.92399126214235
- 19.6217862894734 split increased to 2 itime 947130
+ acceleration/energy drift too large 7.58938092984247
+ 22.9615923802984 split increased to 2 itime 942358
itsplit 1
- acceleration/energy drift too large 4.44413427051592
- 11.1965624469534 split increased to 2 itime 947379
+ acceleration/energy drift too large 2.76641659989110
+ 14.3964130983322 split increased to 2 itime 942788
itsplit 1
Velocities reset to random values, time 189999.80
- acceleration/energy drift too large 7.95170900010183
- 16.0403857853207 split increased to 2 itime 956953
- itsplit 1
-Velocities reset to random values, time 191999.80
- acceleration/energy drift too large 3.88227067437058
- 12.3818961742087 split increased to 2 itime 962441
- itsplit 1
- acceleration/energy drift too large 1.91940650863044
- 10.9909115308605 split increased to 2 itime 962586
+ acceleration/energy drift too large 6.58530653390531
+ 22.4859420632773 split increased to 2 itime 953719
itsplit 1
- acceleration/energy drift too large 5.07543071705197
- 17.9752152130500 split increased to 2 itime 963761
+ acceleration/energy drift too large 2.20946495883106
+ 11.2370277953960 split increased to 2 itime 953862
itsplit 1
- acceleration/energy drift too large 7.32558398952722
- 24.1541787607772 split increased to 2 itime 965923
+ acceleration/energy drift too large 5.02444840583848
+ 16.0241584872741 split increased to 2 itime 955055
itsplit 1
- acceleration/energy drift too large 6.29291139990231
- 14.9733999594814 split increased to 2 itime 967005
- itsplit 1
- acceleration/energy drift too large 5.42351278756249
- 11.8073304271930 split increased to 2 itime 968426
- itsplit 1
-Velocities reset to random values, time 193999.80
- acceleration/energy drift too large 5.26392357973576
- 14.3438652882825 split increased to 2 itime 970276
- itsplit 1
- acceleration/energy drift too large 7.10056378156876
- 21.0815361545108 split increased to 2 itime 971091
- itsplit 1
- acceleration/energy drift too large 7.00204377159050
- 33.9545951206751 split increased to 2 itime 971273
+Velocities reset to random values, time 191999.80
+ acceleration/energy drift too large 2.10299074366612
+ 19.5004738340991 split increased to 2 itime 960574
itsplit 1
- acceleration/energy drift too large 5.09513342266119
- 11.7213418980924 split increased to 2 itime 971299
+ acceleration/energy drift too large 5.41995275991857
+ 17.5218697503181 split increased to 2 itime 961110
itsplit 1
- acceleration/energy drift too large 4.30359656078966
- 14.0888901984776 split increased to 2 itime 971356
+ acceleration/energy drift too large 11.9102885387065
+ 71.0034174953536 split increased to 2 itime 965692
itsplit 1
- acceleration/energy drift too large 2.58733577733941
- 10.1340104061563 split increased to 2 itime 972543
+ acceleration/energy drift too large 11.1274389276124
+ 65.4047394032986 split increased to 2 itime 966331
itsplit 1
- acceleration/energy drift too large 7.04853762090654
- 21.7997432260659 split increased to 2 itime 973980
+ acceleration/energy drift too large 4.24867145405369
+ 12.0764923969973 split increased to 2 itime 966904
itsplit 1
- acceleration/energy drift too large 2.54390496908168
- 15.2648117306652 split increased to 2 itime 974948
+ acceleration/energy drift too large 3.82817695875608
+ 10.1489345125422 split increased to 2 itime 966955
itsplit 1
- acceleration/energy drift too large 5.22808569483512
- 20.0312195239320 split increased to 2 itime 975412
+ acceleration/energy drift too large 7.47896016748512
+ 27.6262383698179 split increased to 2 itime 968640
itsplit 1
- acceleration/energy drift too large 12.8049007615437
- 76.6612572857203 split increased to 2 itime 975689
+Velocities reset to random values, time 193999.80
+ acceleration/energy drift too large 3.94393782285029
+ 10.5862614622132 split increased to 2 itime 972125
itsplit 1
- acceleration/energy drift too large 9.75237524437588
- 40.9913114743635 split increased to 2 itime 977521
+ acceleration/energy drift too large 5.76091206616941
+ 11.5268674559521 split increased to 2 itime 975965
itsplit 1
- acceleration/energy drift too large 5.55151145797565
- 10.5312927001477 split increased to 2 itime 978203
+ acceleration/energy drift too large 5.71679793282402
+ 14.0795604230499 split increased to 2 itime 977564
itsplit 1
- acceleration/energy drift too large 2.93913685715332
- 17.6046835348518 split increased to 2 itime 979937
+ acceleration/energy drift too large 3.62396320322734
+ 28.6225936301255 split increased to 2 itime 979056
itsplit 1
Velocities reset to random values, time 195999.80
- acceleration/energy drift too large 7.54353338169035
- 22.8244577386226 split increased to 2 itime 981896
+ acceleration/energy drift too large 4.18453503321953
+ 11.0635650122307 split increased to 2 itime 980017
itsplit 1
- acceleration/energy drift too large 4.13452104677707
- 10.1160485726259 split increased to 2 itime 986603
+ acceleration/energy drift too large 7.73835889693810
+ 24.2414778992307 split increased to 2 itime 980985
itsplit 1
- acceleration/energy drift too large 6.03543947294234
- 23.2989464543245 split increased to 2 itime 986669
+ acceleration/energy drift too large 12.3730317994160
+ 71.8787411639125 split increased to 2 itime 981576
itsplit 1
- acceleration/energy drift too large 7.92798677691667
- 30.0388009219789 split increased to 2 itime 988554
+ acceleration/energy drift too large 1.75743579269170
+ 12.6933438961326 split increased to 2 itime 983419
itsplit 1
- acceleration/energy drift too large 5.31692501678335
- 13.8512760187820 split increased to 2 itime 989957
+ acceleration/energy drift too large 6.32615527831737
+ 17.2147332675926 split increased to 2 itime 985069
itsplit 1
Velocities reset to random values, time 197999.80
- acceleration/energy drift too large 7.15836158292127
- 25.7357034270101 split increased to 2 itime 991444
- itsplit 1
- acceleration/energy drift too large 5.74650167122276
- 10.9649190029274 split increased to 2 itime 992540
- itsplit 1
- acceleration/energy drift too large 8.74458295681060
- 33.2793340322996 split increased to 2 itime 993962
- itsplit 1
- acceleration/energy drift too large 12.8512992637313
- 65.7288487992138 split increased to 2 itime 994516
- itsplit 1
- acceleration/energy drift too large 4.81937959442598
- 12.5280390905933 split increased to 2 itime 994887
+ acceleration/energy drift too large 6.26052207476379
+ 18.1020521060995 split increased to 2 itime 991330
itsplit 1
- acceleration/energy drift too large 6.33559315789479
- 28.5393789350739 split increased to 2 itime 995588
+ acceleration/energy drift too large 4.67394120722699
+ 10.8622066679894 split increased to 2 itime 994289
itsplit 1
- acceleration/energy drift too large 4.72205985443675
- 12.6198064878400 split increased to 2 itime 996874
+ acceleration/energy drift too large 5.22911240035505
+ 12.3138345895850 split increased to 2 itime 995212
itsplit 1
- acceleration/energy drift too large 7.47385327641237
- 22.6954561670628 split increased to 2 itime 998506
+ acceleration/energy drift too large 6.33230397412798
+ 16.8702364297813 split increased to 2 itime 996909
itsplit 1
- acceleration/energy drift too large 3.91779725444293
- 23.2915438916753 split increased to 2 itime 998545
+ acceleration/energy drift too large 4.53146621264599
+ 18.1733607039933 split increased to 2 itime 998421
itsplit 1
Velocities reset to random values, time 199999.80
REMD synchro at 1000000
=================================== Timing ===================================
- MD calculations setup: 3.90625E-03
- Energy & gradient evaluation: 3.08043E+02
+ MD calculations setup: 1.17188E-02
+ Energy & gradient evaluation: 3.75598E+02
Stochastic MD setup: 0.00000E+00
Stochastic MD step setup: 0.00000E+00
- MD steps: 3.25070E+02
+ MD steps: 4.09824E+02
============================ End of MD calculation ===========================
CG processor 0 is finishing work.
- Total wall clock time 325.085937500000 sec
+ Total wall clock time 409.886718750000 sec
projects / unres.git / blobdiff