--- /dev/null
+--------------------------------------------------------------------------------
+ FILE ASSIGNMENT
+--------------------------------------------------------------------------------
+ Input file : 1L2Y_REMD.inp
+ Output file : 1L2Y_REMD.out_GB000
+
+ Sidechain potential file :
+ /users/pk376/unres-git/unres/PARAM/sc_GB_opt.1gab_3S_qclass5no310-shan2-sc-16-1
+ 0-8k
+ 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/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/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 3.1 build 0
+ Compiled Wed Nov 20 08:38:19 EST 2013
+ Compiled by pk376@matrix.chem.cornell.edu
+ OS name: Linux
+ OS release: Linux-2.6.34.9-69.fc13.x86_64
+ Fortran Compiler: /opt/intel/Compiler/11.1/046/bin
+ /intel64/ifort
+ MD Force field: GAB
+ CPPFLAGS = PROCOR -DUNRES -DISNAN -DSPLITELE -DLAN
+ G0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DLINUX
+ -DPGI -DMP -DMPI
+ ++++ End of compile info ++++
+
+Potential is GB , exponents are 6 12
+
+Disulfide bridge parameters:
+S-S bridge energy: -5.50
+d0cm: 3.78 akcm: 15.10
+akth: 11.00 akct: 12.00
+v1ss: -1.08 v2ss: 7.61 v3ss: 13.70
+ MPI: node= 0 iseed(4)= 0 0 -46
+ -45086
+ ran_num 6.422640197456531E-013
+RMSDBC = 3.0
+RMSDBC1 = 0.5
+RMSDBC1MAX = 1.5
+DRMS = 0.1
+RMSDBCM = 3.0
+Time limit (min): 960.0
+ RESCALE_MODE 2
+Library routine used to diagonalize matrices.
+
+=========================== Parameters of the MD run ===========================
+
+The units are:
+positions: angstrom, time: 48.9 fs
+velocity: angstrom/(48.9 fs), acceleration: angstrom/(48.9 fs)**2
+energy: kcal/mol, temperature: K
+
+ Number of time steps: 1000000
+ Initial time step of numerical integration: 0.20000 natural units
+ 9.78000 fs
+A-MTS algorithm used; initial time step for fast-varying short-range forces split into 1 steps.
+Short-range force cutoff 2.00 lambda 0.30
+Maximum acceleration threshold to reduce the time step/increase split number: 10.00000
+Maximum predicted energy drift to reduce the timestep/increase split number: 10.00000
+ Maximum velocity threshold to reduce velocities: 20.00000
+ Frequency of property output: 10000
+ Frequency of coordinate output: 10000
+
+Langevin dynamics calculation with direct integration of Langevin equations
+
+ Temperature: 300.00000
+ Viscosity of the solvent: 0.89040
+ Radius of solvent molecule: 1.40000
+ Scaling factor of the friction forces: 0.02000
+ Eta of the solvent in natural units: 49.27846
+
+Radii of site types and friction coefficients and std's of stochastic forces of fully exposed sites
+
+ p 5.00 6.30764 6.13033
+ CYS 5.00 6.30764 6.13033
+ MET 6.20 7.49033 6.68037
+ PHE 6.80 8.08167 6.93906
+ ILE 6.20 7.49033 6.68037
+ LEU 6.30 7.58888 6.72418
+ VAL 5.80 7.09610 6.50220
+ TRP 7.20 8.47589 7.10629
+ TYR 6.90 8.18022 6.98124
+ ALA 4.60 5.91342 5.93567
+ GLY 3.80 5.12496 5.52580
+ THR 5.60 6.89898 6.41125
+ SER 4.80 6.11053 6.03378
+ GLN 6.10 7.39177 6.63628
+ ASN 5.70 6.99754 6.45688
+ GLU 6.10 7.39177 6.63628
+ ASP 5.60 6.89898 6.41125
+ HIS 6.20 7.49033 6.68037
+ ARG 6.80 8.08167 6.93906
+ LYS 6.30 7.58888 6.72418
+ PRO 5.60 6.89898 6.41125
+
+============================== End of MD run setup =============================
+
+ REMD setup
+ NREP= 16
+ NSTEX= 100000
+ SYNC= T
+ NSYN= 100000
+ TRAJCACHE= 1
+ tlist 250.000000000000 260.000000000000 270.000000000000
+ 280.000000000000 290.000000000000 300.000000000000
+ 310.000000000000 320.000000000000 330.000000000000
+ 340.000000000000 350.000000000000 360.000000000000
+ 370.000000000000 380.000000000000 390.000000000000
+ 400.000000000000
+ mlist 1 1 1 1 1 1
+ 1 1 1 1 1 1
+ 1 1 1 1
+ Total number of replicas 16
+
+============================== End of REMD run setup =============================
+
+
+Energy-term weights (unscaled):
+
+WSCC= 1.352790 (SC-SC)
+WSCP= 1.593040 (SC-p)
+WELEC= 0.715340 (p-p electr)
+WVDWPP= 0.113710 (p-p VDW)
+WBOND= 1.000000 (stretching)
+WANG= 1.138730 (bending)
+WSCLOC= 0.162580 (SC local)
+WTOR= 1.985990 (torsional)
+WTORD= 1.570690 (double torsional)
+WSTRAIN= 1.000000 (SS bridges & dist. cnstr.)
+WEL_LOC= 0.160360 (multi-body 3-rd order)
+WCORR4= 0.428870 (multi-body 4th order)
+WCORR5= 0.000000 (multi-body 5th order)
+WCORR6= 0.000000 (multi-body 6th order)
+WSCCOR= 0.000000 (back-scloc correlation)
+WTURN3= 1.687220 (turns, 3rd order)
+WTURN4= 0.662300 (turns, 4th order)
+WTURN6= 0.000000 (turns, 6th order)
+
+Hydrogen-bonding correlation between contact pairs of peptide groups
+
+Scaling factor of 1,4 SC-p interactions: 0.400
+General scaling factor of SC-p interactions: 1.000
+
+Energy-term weights (scaled):
+
+WSCC= 1.352790 (SC-SC)
+WSCP= 1.593040 (SC-p)
+WELEC= 0.715340 (p-p electr)
+WVDWPP= 0.113710 (p-p VDW)
+WBOND= 1.000000 (stretching)
+WANG= 1.138730 (bending)
+WSCLOC= 0.162580 (SC local)
+WTOR= 1.985990 (torsional)
+WTORD= 1.570690 (double torsional)
+WSTRAIN= 1.000000 (SS bridges & dist. cnstr.)
+WEL_LOC= 0.160360 (multi-body 3-rd order)
+WCORR4= 0.428870 (multi-body 4th order)
+WCORR5= 0.000000 (multi-body 5th order)
+WCORR6= 0.000000 (multi-body 6th order)
+WSCCOR= 0.000000 (back-scloc correlatkion)
+WTURN3= 1.687220 (turns, 3rd order)
+WTURN4= 0.662300 (turns, 4th order)
+WTURN6= 0.000000 (turns, 6th order)
+ Reference temperature for weights calculation: 300.000000000000
+ Parameters of the SS-bond potential:
+ D0CM 3.78000000000000 AKCM 15.1000000000000 AKTH
+ 11.0000000000000 AKCT 12.0000000000000
+ V1SS -1.08000000000000 V2SS 7.61000000000000 V3SS
+ 13.7000000000000
+ EBR -5.50000000000000 SS_DEPTH -7.39571661678271
+ HT 0.000000000000000E+000
+PDB data will be read from file ../../../1L2Y.pdb
+ Nres: 21
+Backbone and SC coordinates as read from the PDB
+ 1 21 D -9.841 4.399 -5.051 -9.841 4.399 -5.051
+ 2 14 ASN -8.608 3.135 -1.618 -10.407 3.153 -2.437
+ 3 5 LEU -4.923 4.002 -2.452 -4.618 6.091 -1.850
+ 4 8 TYR -3.690 2.738 0.981 -1.959 3.143 3.797
+ 5 4 ILE -5.857 -0.449 0.613 -7.484 -0.369 1.074
+ 6 13 GLN -4.122 -1.167 -2.743 -5.089 -1.450 -4.853
+ 7 7 TRP -0.716 -0.631 -0.993 1.727 0.440 1.450
+ 8 5 LEU -1.641 -2.932 1.963 -2.244 -2.097 3.799
+ 9 19 LYS -3.024 -5.791 -0.269 -3.820 -5.527 -3.146
+ 10 16 ASP 0.466 -6.016 -1.905 0.653 -5.125 -3.676
+ 11 10 GLY 2.060 -6.618 1.593 2.060 -6.618 1.593
+ 12 10 GLY 2.626 -2.967 2.723 2.626 -2.967 2.723
+ 13 20 PRO 6.333 -2.533 3.806 5.724 -2.372 5.058
+ 14 12 SER 7.049 -6.179 2.704 6.757 -6.938 3.675
+ 15 12 SER 6.389 -5.315 -1.015 5.245 -5.350 -1.546
+ 16 10 GLY 9.451 -3.116 -1.870 9.451 -3.116 -1.870
+ 17 18 ARG 7.289 0.084 -2.054 5.225 -1.826 -3.986
+ 18 20 PRO 6.782 3.088 0.345 7.458 3.741 -0.688
+ 19 20 PRO 3.287 4.031 1.686 4.025 4.206 2.856
+ 20 20 PRO 1.185 6.543 -0.353 0.358 5.421 -0.430
+ 21 12 SER 0.852 10.027 1.285 1.151 10.636 1.488
+ 22 21 D -1.250 12.539 -0.754 -1.250 12.539 -0.754
+nsup= 20 nstart_sup= 2
+ ITEL
+ 1 21 0
+ 2 14 1
+ 3 5 1
+ 4 8 1
+ 5 4 1
+ 6 13 1
+ 7 7 1
+ 8 5 1
+ 9 19 1
+ 10 16 1
+ 11 10 1
+ 12 10 2
+ 13 20 1
+ 14 12 1
+ 15 12 1
+ 16 10 1
+ 17 18 2
+ 18 20 2
+ 19 20 2
+ 20 20 1
+ 21 12 0
+ ns= 0 iss:
+Boundaries in phi angle sampling:
+D 1 -180.0 180.0
+ASN 2 -180.0 180.0
+LEU 3 -180.0 180.0
+TYR 4 -180.0 180.0
+ILE 5 -180.0 180.0
+GLN 6 -180.0 180.0
+TRP 7 -180.0 180.0
+LEU 8 -180.0 180.0
+LYS 9 -180.0 180.0
+ASP 10 -180.0 180.0
+GLY 11 -180.0 180.0
+GLY 12 -180.0 180.0
+PRO 13 -180.0 180.0
+SER 14 -180.0 180.0
+SER 15 -180.0 180.0
+GLY 16 -180.0 180.0
+ARG 17 -180.0 180.0
+PRO 18 -180.0 180.0
+PRO 19 -180.0 180.0
+PRO 20 -180.0 180.0
+SER 21 -180.0 180.0
+D 22 -180.0 180.0
+nsup= 20
+ nsup= 20 nstart_sup= 2 nstart_seq= 2
+ NZ_START= 2 NZ_END= 21
+ IZ_SC= 0
+ Contact order: 0.308441558441558
+ Shifting contacts: 2 2
+ 1 ILE 5 ASN 2
+ 2 TRP 7 TYR 4
+ 3 LEU 8 TYR 4
+ 4 LEU 8 ILE 5
+ 5 LYS 9 GLN 6
+ 6 GLY 12 TRP 7
+ 7 GLY 12 LEU 8
+ 8 SER 14 GLY 11
+ 9 SER 15 ASP 10
+ 10 SER 15 GLY 11
+ 11 PRO 19 TRP 7
+ 12 PRO 20 LEU 3
+ 13 PRO 20 TYR 4
+ 14 PRO 20 TRP 7
+Extended chain initial geometry.
+
+Geometry of the virtual chain.
+ Res d Theta Gamma Dsc Alpha Beta
+D 1 0.000 0.000 0.000 0.000 0.000 0.000
+ASN 2 3.800 0.000 0.000 1.684 110.000 -120.000
+LEU 3 3.800 90.000 0.000 1.939 110.000 -120.000
+TYR 4 3.800 90.000 180.000 2.484 110.000 -120.000
+ILE 5 3.800 90.000 180.000 1.776 110.000 -120.000
+GLN 6 3.800 90.000 180.000 2.240 110.000 -120.000
+TRP 7 3.800 90.000 180.000 2.605 110.000 -120.000
+LEU 8 3.800 90.000 180.000 1.939 110.000 -120.000
+LYS 9 3.800 90.000 180.000 2.541 110.000 -120.000
+ASP 10 3.800 90.000 180.000 1.709 110.000 -120.000
+GLY 11 3.800 90.000 180.000 0.000 110.000 -120.000
+GLY 12 3.800 90.000 180.000 0.000 110.000 -120.000
+PRO 13 3.800 90.000 180.000 1.345 110.000 -120.000
+SER 14 3.800 90.000 180.000 1.150 110.000 -120.000
+SER 15 3.800 90.000 180.000 1.150 110.000 -120.000
+GLY 16 3.800 90.000 180.000 0.000 110.000 -120.000
+ARG 17 3.800 90.000 180.000 3.020 110.000 -120.000
+PRO 18 3.800 90.000 180.000 1.345 110.000 -120.000
+PRO 19 3.800 90.000 180.000 1.345 110.000 -120.000
+PRO 20 3.800 90.000 180.000 1.345 110.000 -120.000
+SER 21 3.800 90.000 180.000 1.150 110.000 -120.000
+D 22 3.800 90.000 180.000 0.000 0.000 0.000
+
+
+********************************************************************************
+ Processor 0: end reading molecular data.
+********************************************************************************
+
+
+Replica exchange molecular dynamics (REMD) calculation.
+
+********************************************************************************
+
+ Calling chainbuild
+ Calling REMD
+ MREMD 8 time before 4.687500000000000E-002
+ NREP= 16
+ i2rep 1 2 3 4 5 6 7 8
+ i2set 1 1 1 1 1 1 1 1
+ i,j,il,il1,i_index(i,j,il,il1)
+ifirst 1
+ nupa 1: 2
+ndowna 1:
+ nupa 2: 3
+ndowna 2: 1
+ nupa 3: 4
+ndowna 3: 2
+ nupa 4: 5
+ndowna 4: 3
+ nupa 5: 6
+ndowna 5: 4
+ nupa 6: 7
+ndowna 6: 5
+ nupa 7: 8
+ndowna 7: 6
+ nupa 8: 9
+ndowna 8: 7
+ REMD Temperature: 250.00000
+====================MD calculation start====================
+ Initial velocities randomly generated
+ Initial velocities
+ 0 0.02069 0.05735 -0.16550 0.00000 0.00000 0.00000
+ 1 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000
+ 2 -0.32876 -0.20726 -0.00156 -0.06303 -0.02233 0.22619
+ 3 0.25246 0.18847 0.12917 0.23917 0.13789 0.08528
+ 4 0.09890 -0.10900 0.13430 0.09430 -0.08759 0.02991
+ 5 0.05293 -0.08192 0.07599 0.03541 0.02418 -0.13426
+ 6 0.01106 0.15012 -0.13429 -0.01486 0.10588 -0.15072
+ 7 -0.00922 -0.05032 0.03343 -0.17306 0.05869 0.04136
+ 8 -0.01642 0.12268 -0.04117 0.02116 0.09728 0.03398
+ 9 -0.24153 -0.01761 0.08700 -0.20570 -0.15587 -0.04194
+ 10 0.12837 -0.05524 -0.16763 0.18636 -0.14195 -0.15819
+ 11 -0.12912 0.12012 -0.00669 0.00000 0.00000 0.00000
+ 12 0.18024 -0.22147 0.01606 0.00000 0.00000 0.00000
+ 13 -0.13972 0.25567 0.06619 0.05987 0.13532 0.09181
+ 14 0.10136 -0.29158 0.14318 -0.02692 -0.08844 0.04927
+ 15 0.13268 0.09441 -0.21684 -0.12710 0.07259 0.06988
+ 16 -0.10926 0.13472 0.13695 0.00000 0.00000 0.00000
+ 17 -0.08222 -0.14474 -0.18471 -0.07262 -0.07774 -0.09353
+ 18 0.22036 0.08274 0.12819 -0.01893 0.09330 0.04480
+ 19 -0.13103 -0.06596 -0.26603 -0.11327 -0.06258 -0.02718
+ 20 0.26050 0.08237 0.51647 0.02143 0.14877 0.17591
+ 21 0.00000 0.00000 0.00000 -0.12529 -0.05874 -0.20044
+ 22 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000
+ Calling the zero-angular momentum subroutine
+ vcm right after adjustment:
+ 2.082625259986501E-017 5.819099991138752E-018 -2.000953681163500E-017
+
+
+ alpha-carbon coordinates centroid coordinates
+ X Y Z X Y Z
+D ( 1) 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000
+ASN( 2) 3.80000 0.00000 0.00000 3.64779 0.96674 1.37044
+LEU( 3) 3.80000 -3.80000 0.00000 2.68687 -3.62474 -1.57795
+TYR( 4) 7.60000 -3.80000 0.00000 7.37548 -2.37399 2.02147
+ILE( 5) 7.60000 -7.60000 0.00000 6.58044 -7.43947 -1.44530
+GLN( 6) 11.40000 -7.60000 0.00000 11.19753 -6.31407 1.82291
+TRP( 7) 11.40000 -11.40000 0.00000 9.90453 -11.16454 -2.11994
+LEU( 8) 15.20000 -11.40000 0.00000 15.02474 -10.28687 1.57795
+LYS( 9) 15.20000 -15.20000 0.00000 13.74127 -14.97033 -2.06786
+ASP( 10) 19.00000 -15.20000 0.00000 18.84553 -14.21890 1.39078
+GLY( 11) 19.00000 -19.00000 0.00000 19.00000 -19.00000 0.00000
+GLY( 12) 22.80000 -19.00000 0.00000 22.80000 -19.00000 0.00000
+PRO( 13) 22.80000 -22.80000 0.00000 22.02787 -22.67843 -1.09456
+SER( 14) 26.60000 -22.80000 0.00000 26.49606 -22.13981 0.93587
+SER( 15) 26.60000 -26.60000 0.00000 25.93981 -26.49606 -0.93587
+GLY( 16) 30.40000 -26.60000 0.00000 30.40000 -26.60000 0.00000
+ARG( 17) 30.40000 -30.40000 0.00000 28.66629 -30.12703 -2.45767
+PRO( 18) 34.20000 -30.40000 0.00000 34.07843 -29.62787 1.09456
+PRO( 19) 34.20000 -34.20000 0.00000 33.42787 -34.07843 -1.09456
+PRO( 20) 38.00000 -34.20000 0.00000 37.87843 -33.42787 1.09456
+SER( 21) 38.00000 -38.00000 0.00000 37.33981 -37.89606 -0.93587
+D ( 22) 41.80000 -38.00000 0.00000 41.80000 -38.00000 0.00000
+
+Geometry of the virtual chain.
+ Res d Theta Gamma Dsc Alpha Beta
+D 1 0.000 0.000 0.000 0.000 0.000 0.000
+ASN 2 3.800 0.000 0.000 1.684 110.000 -120.000
+LEU 3 3.800 90.000 0.000 1.939 110.000 -120.000
+TYR 4 3.800 90.000 180.000 2.484 110.000 -120.000
+ILE 5 3.800 90.000 180.000 1.776 110.000 -120.000
+GLN 6 3.800 90.000 180.000 2.240 110.000 -120.000
+TRP 7 3.800 90.000 180.000 2.605 110.000 -120.000
+LEU 8 3.800 90.000 180.000 1.939 110.000 -120.000
+LYS 9 3.800 90.000 180.000 2.541 110.000 -120.000
+ASP 10 3.800 90.000 180.000 1.709 110.000 -120.000
+GLY 11 3.800 90.000 180.000 0.000 0.000 180.000
+GLY 12 3.800 90.000 180.000 0.000 0.000 180.000
+PRO 13 3.800 90.000 180.000 1.345 110.000 -120.000
+SER 14 3.800 90.000 180.000 1.150 110.000 -120.000
+SER 15 3.800 90.000 180.000 1.150 110.000 -120.000
+GLY 16 3.800 90.000 180.000 0.000 0.000 180.000
+ARG 17 3.800 90.000 180.000 3.020 110.000 -120.000
+PRO 18 3.800 90.000 180.000 1.345 110.000 -120.000
+PRO 19 3.800 90.000 180.000 1.345 110.000 -120.000
+PRO 20 3.800 90.000 180.000 1.345 110.000 -120.000
+SER 21 3.800 90.000 180.000 1.150 110.000 -120.000
+D 22 3.800 90.000 180.000 0.000 0.000 180.000
+ Potential energy and its components
+
+Virtual-chain energies:
+
+EVDW= -1.854624E+01 WEIGHT= 1.352790E+00 (SC-SC)
+EVDW2= 2.387106E+01 WEIGHT= 1.593040E+00 (SC-p)
+EES= -7.520330E+00 WEIGHT= 8.010569E-01 (p-p)
+EVDWPP= -2.624923E+01 WEIGHT= 1.137100E-01 (p-p VDW)
+ESTR= 8.665144E-27 WEIGHT= 1.000000E+00 (stretching)
+EBE= 1.082023E+00 WEIGHT= 1.138730E+00 (bending)
+ESC= 9.168846E+01 WEIGHT= 1.625800E-01 (SC local)
+ETORS= 2.664535E-15 WEIGHT= 2.223965E+00 (torsional)
+ETORSD= -2.547586E+00 WEIGHT= 1.930120E+00 (double torsional)
+EHPB= 0.000000E+00 WEIGHT= 1.000000E+00 (SS bridges & dist. cnstr.)
+ECORR4= -4.501075E+00 WEIGHT= 5.672548E-01 (multi-body)
+ECORR5= 0.000000E+00 WEIGHT= 0.000000E+00 (multi-body)
+ECORR6= 0.000000E+00 WEIGHT= 0.000000E+00 (multi-body)
+EELLO= 2.197932E+01 WEIGHT= 1.970561E-01 (electrostatic-local)
+ETURN3= -1.258124E+00 WEIGHT= 2.073316E+00 (turns, 3rd order)
+ETURN4= 9.498513E+00 WEIGHT= 8.760064E-01 (turns, 4th order)
+ETURN6= 0.000000E+00 WEIGHT= 0.000000E+00 (turns, 6th order)
+ESCCOR= 0.000000E+00 WEIGHT= 0.000000E+00 (backbone-rotamer corr)
+EDIHC= 0.000000E+00 (dihedral angle constraints)
+ESS= 0.000000E+00 (disulfide-bridge intrinsic energy)
+UCONST= 0.000000E+00 (Constraint energy)
+ETOT= 2.264125E+01 (total)
+
+Initial:
+ Kinetic energy 2.63515E+01
+ potential energy 2.26412E+01
+ total energy 4.89928E+01
+
+ maximum acceleration 9.59318E-01
+
+ Setup time 6.250000000000000E-002
+ acceleration/energy drift too large 5.63918106737272
+ 35.3571855162741 split increased to 2 itime 1028
+ itsplit 1
+ acceleration/energy drift too large 10.8729823992228
+ 52.3145846329672 split increased to 2 itime 1056
+ itsplit 1
+ acceleration/energy drift too large 3.28536102197664
+ 11.7411501261499 split increased to 2 itime 1284
+ itsplit 1
+ acceleration/energy drift too large 5.14796605170366
+ 25.5944222483776 split increased to 2 itime 1464
+ itsplit 1
+ acceleration/energy drift too large 4.30555535081426
+ 12.0515261611403 split increased to 2 itime 1613
+ itsplit 1
+ acceleration/energy drift too large 5.94717809136189
+ 10.3896136034960 split increased to 2 itime 1652
+ itsplit 1
+ acceleration/energy drift too large 10.2204359471954
+ 24.1891695096049 split increased to 2 itime 1662
+ itsplit 1
+ acceleration/energy drift too large 2.44352174824906
+ 15.1453549172462 split increased to 2 itime 1880
+ itsplit 1
+ acceleration/energy drift too large 4.70471505415219
+ 14.3697900658259 split increased to 2 itime 2169
+ itsplit 1
+ acceleration/energy drift too large 2.36696298044121
+ 11.5481023464904 split increased to 2 itime 2988
+ itsplit 1
+ acceleration/energy drift too large 3.11001725079099
+ 11.6433912909899 split increased to 2 itime 2989
+ itsplit 1
+ acceleration/energy drift too large 3.63283289763953
+ 13.5411725430095 split increased to 2 itime 3193
+ itsplit 1
+ acceleration/energy drift too large 4.47921557608526
+ 11.9938670711319 split increased to 2 itime 3425
+ itsplit 1
+ acceleration/energy drift too large 8.91525490425866
+ 42.6973845999645 split increased to 2 itime 3662
+ itsplit 1
+ acceleration/energy drift too large 7.05435429203365
+ 19.2288496136548 split increased to 2 itime 3663
+ itsplit 1
+ acceleration/energy drift too large 4.68246766404941
+ 25.4676990523523 split increased to 2 itime 3937
+ itsplit 1
+ acceleration/energy drift too large 4.49544109901394
+ 28.2205277759573 split increased to 2 itime 4350
+ itsplit 1
+ acceleration/energy drift too large 3.84092228572669
+ 19.3324496146227 split increased to 2 itime 4951
+ itsplit 1
+ acceleration/energy drift too large 4.64153203464570
+ 10.1801404441808 split increased to 2 itime 6769
+ itsplit 1
+ acceleration/energy drift too large 5.07796478963469
+ 13.2741701023061 split increased to 2 itime 6931
+ itsplit 1
+ acceleration/energy drift too large 4.18814303625074
+ 27.1119625402691 split increased to 2 itime 7842
+ itsplit 1
+ acceleration/energy drift too large 3.39169805531536
+ 10.3324838871765 split increased to 2 itime 8797
+ itsplit 1
+ acceleration/energy drift too large 3.50043607321272
+ 25.7966304934517 split increased to 2 itime 9616
+ itsplit 1
+ acceleration/energy drift too large 2.62285471235274
+ 11.8319450262330 split increased to 2 itime 10764
+ itsplit 1
+ acceleration/energy drift too large 2.16115195113438
+ 11.0979197640116 split increased to 2 itime 11010
+ itsplit 1
+ acceleration/energy drift too large 3.07932134835063
+ 22.8366668952950 split increased to 2 itime 11241
+ itsplit 1
+ acceleration/energy drift too large 6.89071594777647
+ 16.6274454383628 split increased to 2 itime 13539
+ itsplit 1
+ acceleration/energy drift too large 8.04340932794725
+ 21.3639306285702 split increased to 2 itime 14319
+ itsplit 1
+ acceleration/energy drift too large 13.4467048311970
+ 70.5032897793779 split increased to 2 itime 14346
+ itsplit 1
+ acceleration/energy drift too large 3.85144891410892
+ 22.4563961669407 split increased to 2 itime 14390
+ itsplit 1
+ acceleration/energy drift too large 5.49359064817051
+ 18.3214897780854 split increased to 2 itime 14701
+ itsplit 1
+ acceleration/energy drift too large 2.63347046167346
+ 10.8011272807313 split increased to 2 itime 16123
+ itsplit 1
+ acceleration/energy drift too large 2.37252164101140
+ 10.0208029603040 split increased to 2 itime 16148
+ itsplit 1
+ acceleration/energy drift too large 6.81894093676270
+ 25.1133974477313 split increased to 2 itime 16666
+ itsplit 1
+ acceleration/energy drift too large 5.02639672515953
+ 38.5450806123208 split increased to 2 itime 16957
+ itsplit 1
+ acceleration/energy drift too large 3.29230213990233
+ 12.8682786761299 split increased to 2 itime 18553
+ itsplit 1
+ acceleration/energy drift too large 5.58321685105274
+ 13.0721496773453 split increased to 2 itime 19557
+ itsplit 1
+ acceleration/energy drift too large 11.4141101491608
+ 57.3686331453835 split increased to 2 itime 19636
+ itsplit 1
+ acceleration/energy drift too large 2.72191053725797
+ 13.3423503274378 split increased to 4 itime 19636
+ itsplit 2
+ acceleration/energy drift too large 3.43807708156927
+ 12.8108481669393 split increased to 2 itime 20554
+ itsplit 1
+ acceleration/energy drift too large 4.01017110729673
+ 11.6262771507421 split increased to 2 itime 21590
+ itsplit 1
+ acceleration/energy drift too large 3.15493106749717
+ 19.3017873000702 split increased to 2 itime 21638
+ itsplit 1
+ acceleration/energy drift too large 4.99772490386704
+ 13.0993452444689 split increased to 2 itime 22369
+ itsplit 1
+ acceleration/energy drift too large 3.75783880578601
+ 10.2013700416861 split increased to 2 itime 22562
+ itsplit 1
+ acceleration/energy drift too large 4.80981678325877
+ 11.9977359761756 split increased to 2 itime 24031
+ itsplit 1
+ acceleration/energy drift too large 2.47732674467058
+ 10.8948782515287 split increased to 2 itime 24847
+ itsplit 1
+ acceleration/energy drift too large 13.4640950242825
+ 125.047283850475 split increased to 2 itime 25440
+ itsplit 1
+ acceleration/energy drift too large 3.58314504573760
+ 14.4500196135448 split increased to 4 itime 25440
+ itsplit 1
+ acceleration/energy drift too large 5.04824018885210
+ 15.8361545775069 split increased to 2 itime 26725
+ itsplit 1
+ acceleration/energy drift too large 4.36035907773934
+ 10.6716890009158 split increased to 2 itime 26866
+ itsplit 1
+ acceleration/energy drift too large 12.6663032769869
+ 56.9234494407235 split increased to 2 itime 27001
+ itsplit 1
+ acceleration/energy drift too large 2.64325020681395
+ 12.3491706106436 split increased to 4 itime 27001
+ itsplit 1
+ acceleration/energy drift too large 6.41512050094965
+ 15.1041870349427 split increased to 2 itime 27035
+ itsplit 1
+ acceleration/energy drift too large 3.74516194471741
+ 11.5017789098039 split increased to 2 itime 27125
+ itsplit 1
+ acceleration/energy drift too large 6.29261702853444
+ 16.7293063203290 split increased to 2 itime 27647
+ itsplit 1
+ acceleration/energy drift too large 7.47098605918827
+ 23.8508160077668 split increased to 2 itime 28803
+ itsplit 1
+ acceleration/energy drift too large 6.30271162717393
+ 12.7628672754401 split increased to 2 itime 29991
+ itsplit 1
+ acceleration/energy drift too large 5.54986684291316
+ 19.4528888820941 split increased to 2 itime 30047
+ itsplit 1
+ acceleration/energy drift too large 6.34572216646319
+ 12.4653243392076 split increased to 2 itime 30049
+ itsplit 1
+ acceleration/energy drift too large 5.55482687422360
+ 13.6199842088656 split increased to 2 itime 30057
+ itsplit 1
+ acceleration/energy drift too large 6.95060901150181
+ 13.6408588613389 split increased to 2 itime 30059
+ itsplit 1
+ acceleration/energy drift too large 5.73954928734024
+ 12.1213607224673 split increased to 2 itime 30071
+ itsplit 1
+ acceleration/energy drift too large 2.84073418788950
+ 10.1139425826687 split increased to 2 itime 30820
+ itsplit 1
+ acceleration/energy drift too large 5.86409442748216
+ 22.6716503125443 split increased to 2 itime 31189
+ itsplit 1
+ acceleration/energy drift too large 10.9541895939377
+ 51.8985245073042 split increased to 2 itime 31530
+ itsplit 1
+ acceleration/energy drift too large 2.59770862061949
+ 11.8706998198693 split increased to 4 itime 31530
+ itsplit 2
+ acceleration/energy drift too large 4.22864557277935
+ 21.7239295763887 split increased to 2 itime 32547
+ itsplit 1
+ acceleration/energy drift too large 13.8438279263302
+ 106.191166832147 split increased to 2 itime 32909
+ itsplit 1
+ acceleration/energy drift too large 6.54942310822148
+ 23.0654746132271 split increased to 2 itime 33631
+ itsplit 1
+ acceleration/energy drift too large 12.1939973661612
+ 87.6826735717594 split increased to 2 itime 33635
+ itsplit 1
+ acceleration/energy drift too large 7.27570857673955
+ 23.2112289421643 split increased to 2 itime 33962
+ itsplit 1
+ acceleration/energy drift too large 3.85553746116164
+ 15.4451093356813 split increased to 2 itime 34184
+ itsplit 1
+ acceleration/energy drift too large 4.14576824322283
+ 13.4350031698828 split increased to 2 itime 34201
+ itsplit 1
+ acceleration/energy drift too large 6.93816987403713
+ 15.0855934532604 split increased to 2 itime 34363
+ itsplit 1
+ acceleration/energy drift too large 4.47954255680826
+ 17.4722735906525 split increased to 2 itime 34530
+ itsplit 1
+ acceleration/energy drift too large 1.44179325647977
+ 12.9249136682216 split increased to 4 itime 34530
+ itsplit 1
+ acceleration/energy drift too large 2.62285837341333
+ 15.0000428149156 split increased to 2 itime 34606
+ itsplit 1
+ acceleration/energy drift too large 5.61369312635986
+ 17.7320034406705 split increased to 2 itime 34671
+ itsplit 1
+ acceleration/energy drift too large 3.76717711157113
+ 13.3052357716413 split increased to 2 itime 35409
+ itsplit 1
+ acceleration/energy drift too large 4.48808286292798
+ 12.2726670400669 split increased to 2 itime 35686
+ itsplit 1
+ acceleration/energy drift too large 5.93308215003441
+ 15.6469473964777 split increased to 2 itime 35841
+ itsplit 1
+ acceleration/energy drift too large 5.33636814429521
+ 12.9138167925720 split increased to 2 itime 37165
+ itsplit 1
+ acceleration/energy drift too large 2.72290810352853
+ 10.7189912450791 split increased to 2 itime 37876
+ itsplit 1
+ acceleration/energy drift too large 7.14868437520244
+ 29.3379921896970 split increased to 2 itime 38499
+ itsplit 1
+ acceleration/energy drift too large 4.59020477605162
+ 23.8834530863281 split increased to 2 itime 39032
+ itsplit 1
+ acceleration/energy drift too large 5.99735856564086
+ 16.7413538069089 split increased to 2 itime 39105
+ itsplit 1
+ acceleration/energy drift too large 5.34150761973903
+ 13.6252361360669 split increased to 2 itime 39266
+ itsplit 1
+ acceleration/energy drift too large 6.17660191694107
+ 15.6196409080652 split increased to 2 itime 39670
+ itsplit 1
+ acceleration/energy drift too large 9.06174203657497
+ 29.5191425043196 split increased to 2 itime 39952
+ itsplit 1
+ acceleration/energy drift too large 2.41321173108030
+ 12.2013160755494 split increased to 2 itime 40171
+ itsplit 1
+ acceleration/energy drift too large 5.39337308151622
+ 19.4706537380226 split increased to 2 itime 40295
+ itsplit 1
+ acceleration/energy drift too large 4.56774578611308
+ 15.4860881951383 split increased to 2 itime 40618
+ itsplit 1
+ acceleration/energy drift too large 2.95868181634345
+ 11.1487862718852 split increased to 2 itime 42247
+ itsplit 1
+ acceleration/energy drift too large 4.69495367211433
+ 12.9812938213575 split increased to 2 itime 42314
+ itsplit 1
+ acceleration/energy drift too large 11.0980476650334
+ 45.8866926444603 split increased to 2 itime 42924
+ itsplit 1
+ acceleration/energy drift too large 6.85293779517124
+ 30.2115658818096 split increased to 2 itime 42959
+ itsplit 1
+ acceleration/energy drift too large 5.57286922741466
+ 18.8623681561010 split increased to 2 itime 42992
+ itsplit 1
+ acceleration/energy drift too large 7.90781967798329
+ 23.1367757227237 split increased to 2 itime 43128
+ itsplit 1
+ acceleration/energy drift too large 4.34196457651407
+ 12.9784414641500 split increased to 2 itime 43332
+ itsplit 1
+ acceleration/energy drift too large 4.77705582667231
+ 13.9256602698986 split increased to 2 itime 43333
+ itsplit 1
+ acceleration/energy drift too large 9.21726196517588
+ 20.4160826997983 split increased to 2 itime 43350
+ itsplit 1
+ acceleration/energy drift too large 3.64701890979240
+ 10.4384760773738 split increased to 2 itime 43707
+ itsplit 1
+ acceleration/energy drift too large 4.55666857674334
+ 23.9126897432624 split increased to 2 itime 46091
+ itsplit 1
+ acceleration/energy drift too large 8.17219825739599
+ 20.5859229021717 split increased to 2 itime 47798
+ itsplit 1
+ acceleration/energy drift too large 4.70691925484453
+ 27.4918862013750 split increased to 2 itime 48601
+ itsplit 1
+ acceleration/energy drift too large 6.81664441642112
+ 36.6802050022921 split increased to 2 itime 48846
+ itsplit 1
+ acceleration/energy drift too large 4.50855971749213
+ 17.8670925252033 split increased to 2 itime 51410
+ itsplit 1
+ acceleration/energy drift too large 8.63002241735634
+ 26.6137085188155 split increased to 2 itime 51421
+ itsplit 1
+ acceleration/energy drift too large 3.93485080699537
+ 11.3177827069448 split increased to 2 itime 53340
+ itsplit 1
+ acceleration/energy drift too large 2.71319576501072
+ 12.6841154182645 split increased to 2 itime 57655
+ itsplit 1
+ acceleration/energy drift too large 3.28866921197398
+ 11.1219189501471 split increased to 2 itime 57715
+ itsplit 1
+ acceleration/energy drift too large 5.15915432944909
+ 35.5962403316739 split increased to 2 itime 59198
+ itsplit 1
+ acceleration/energy drift too large 10.6814875042828
+ 52.8372656768800 split increased to 2 itime 59318
+ itsplit 1
+ acceleration/energy drift too large 2.51286079612546
+ 10.2505226181714 split increased to 2 itime 59458
+ itsplit 1
+ acceleration/energy drift too large 5.41425056152957
+ 29.5141317587388 split increased to 2 itime 62029
+ itsplit 1
+ acceleration/energy drift too large 6.05550280158633
+ 19.4682803761979 split increased to 2 itime 62759
+ itsplit 1
+ acceleration/energy drift too large 6.24107069025594
+ 17.7800627311053 split increased to 2 itime 62813
+ itsplit 1
+ acceleration/energy drift too large 4.32323973696410
+ 19.8338093099893 split increased to 2 itime 63177
+ itsplit 1
+ acceleration/energy drift too large 4.65611730036295
+ 15.1899104880647 split increased to 2 itime 63255
+ itsplit 1
+ acceleration/energy drift too large 4.16036111525709
+ 10.0593067222064 split increased to 2 itime 63345
+ itsplit 1
+ acceleration/energy drift too large 3.92377906931795
+ 16.8028456812701 split increased to 2 itime 63604
+ itsplit 1
+ acceleration/energy drift too large 3.59861297460561
+ 14.4455235613579 split increased to 2 itime 64243
+ itsplit 1
+ acceleration/energy drift too large 10.9714370554461
+ 56.5535712014564 split increased to 2 itime 66516
+ itsplit 1
+ acceleration/energy drift too large 5.75575214717111
+ 44.1111013285694 split increased to 2 itime 66643
+ itsplit 1
+ acceleration/energy drift too large 2.50435027381742
+ 12.4430168550362 split increased to 2 itime 67499
+ itsplit 1
+ acceleration/energy drift too large 2.35510498491204
+ 11.3573144733410 split increased to 2 itime 67505
+ itsplit 1
+ acceleration/energy drift too large 1.51165152562169
+ 16.1140123672560 split increased to 2 itime 67511
+ itsplit 1
+ acceleration/energy drift too large 2.49498014480323
+ 16.2130129792738 split increased to 2 itime 67512
+ itsplit 1
+ acceleration/energy drift too large 3.53301627510174
+ 12.5746657697493 split increased to 2 itime 67517
+ itsplit 1
+ acceleration/energy drift too large 3.64623424471759
+ 13.9642963252277 split increased to 2 itime 67518
+ itsplit 1
+ acceleration/energy drift too large 3.45300103930126
+ 10.0487847960034 split increased to 2 itime 67536
+ itsplit 1
+ acceleration/energy drift too large 2.47923980385616
+ 10.4751211942108 split increased to 2 itime 67544
+ itsplit 1
+ acceleration/energy drift too large 3.40846390087046
+ 10.4498025328995 split increased to 2 itime 67563
+ itsplit 1
+ acceleration/energy drift too large 2.57824520705121
+ 10.2401601280585 split increased to 2 itime 67580
+ itsplit 1
+ acceleration/energy drift too large 5.01542852702226
+ 15.4465033628673 split increased to 2 itime 69045
+ itsplit 1
+ acceleration/energy drift too large 2.52533898833681
+ 11.1005865518530 split increased to 2 itime 70062
+ itsplit 1
+ acceleration/energy drift too large 9.46367102227206
+ 46.3169642997431 split increased to 2 itime 72929
+ itsplit 1
+ acceleration/energy drift too large 4.95466213715214
+ 11.8827108164148 split increased to 2 itime 75654
+ itsplit 1
+ acceleration/energy drift too large 11.3679575707500
+ 67.6497354532070 split increased to 2 itime 76885
+ itsplit 1
+ acceleration/energy drift too large 3.50123416185582
+ 25.0787056487061 split increased to 2 itime 77287
+ itsplit 1
+ acceleration/energy drift too large 9.38358974867411
+ 42.6767849838563 split increased to 2 itime 77820
+ itsplit 1
+ acceleration/energy drift too large 10.1711740543284
+ 53.7029902053756 split increased to 2 itime 79424
+ itsplit 1
+ acceleration/energy drift too large 11.1468755220041
+ 54.4699277459658 split increased to 2 itime 81516
+ itsplit 1
+ acceleration/energy drift too large 4.26880124333891
+ 10.0568772608864 split increased to 2 itime 81705
+ itsplit 1
+ acceleration/energy drift too large 8.57374541507521
+ 34.6310067028717 split increased to 2 itime 84173
+ itsplit 1
+ acceleration/energy drift too large 3.56623106209922
+ 12.7238221412873 split increased to 2 itime 84174
+ itsplit 1
+ acceleration/energy drift too large 1.98675147240097
+ 10.3737256929119 split increased to 2 itime 84451
+ itsplit 1
+ acceleration/energy drift too large 5.26834183662620
+ 20.6490486506715 split increased to 2 itime 85129
+ itsplit 1
+ acceleration/energy drift too large 6.16788937233679
+ 12.5998581957218 split increased to 2 itime 86521
+ itsplit 1
+ acceleration/energy drift too large 6.18650133326859
+ 16.8845373890066 split increased to 2 itime 86780
+ itsplit 1
+ acceleration/energy drift too large 7.34963479807984
+ 23.8618488636752 split increased to 2 itime 86958
+ itsplit 1
+ acceleration/energy drift too large 3.60805286127260
+ 26.8650924619129 split increased to 2 itime 92565
+ itsplit 1
+ acceleration/energy drift too large 4.63616507396913
+ 18.1218734268102 split increased to 2 itime 92923
+ itsplit 1
+ acceleration/energy drift too large 3.20459046543764
+ 11.3620149147213 split increased to 2 itime 94519
+ itsplit 1
+ acceleration/energy drift too large 4.59839148274791
+ 10.5289471371568 split increased to 2 itime 94927
+ itsplit 1
+ acceleration/energy drift too large 3.88452616887577
+ 11.4717662571804 split increased to 2 itime 94954
+ itsplit 1
+ acceleration/energy drift too large 4.81436846918973
+ 14.8589513153011 split increased to 2 itime 96747
+ itsplit 1
+ acceleration/energy drift too large 4.13296624004695
+ 18.7294200832409 split increased to 2 itime 96803
+ itsplit 1
+ REMD synchro at 100000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 38.7382812500000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.00000 1
+ACC 2 260.00000 1.00000 1
+ACC 3 270.00000 0.00000 1
+ACC 4 280.00000 0.00000 1
+ACC 5 290.00000 1.00000 1
+ACC 6 300.00000 1.00000 1
+ACC 7 310.00000 0.00000 1
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 3.13001505132709
+ 10.1410210537227 split increased to 2 itime 103113
+ itsplit 1
+ acceleration/energy drift too large 7.42879841185036
+ 25.6372952805707 split increased to 2 itime 104417
+ itsplit 1
+ acceleration/energy drift too large 7.64364978380072
+ 24.9249302213754 split increased to 2 itime 104513
+ itsplit 1
+ acceleration/energy drift too large 5.47929822869888
+ 10.6755074492465 split increased to 2 itime 112758
+ itsplit 1
+ acceleration/energy drift too large 2.59323537439544
+ 17.4426821674308 split increased to 2 itime 114835
+ itsplit 1
+ acceleration/energy drift too large 7.77242588523110
+ 24.8411685599676 split increased to 2 itime 117401
+ itsplit 1
+ acceleration/energy drift too large 7.24317506230297
+ 20.4263142661891 split increased to 2 itime 118820
+ itsplit 1
+ acceleration/energy drift too large 4.44232627491974
+ 11.9474910751349 split increased to 2 itime 121712
+ itsplit 1
+ acceleration/energy drift too large 12.2312904012305
+ 69.8895282295434 split increased to 2 itime 122332
+ itsplit 1
+ acceleration/energy drift too large 2.68948716219164
+ 13.1544607788688 split increased to 4 itime 122332
+ itsplit 2
+ acceleration/energy drift too large 5.26876723129406
+ 13.3006676456201 split increased to 2 itime 124441
+ itsplit 1
+ acceleration/energy drift too large 12.7465853577546
+ 63.6049470107854 split increased to 2 itime 126614
+ itsplit 1
+ acceleration/energy drift too large 5.57583553064118
+ 12.7994856154252 split increased to 2 itime 127139
+ itsplit 1
+ acceleration/energy drift too large 6.49157597489070
+ 19.6322090462846 split increased to 2 itime 127851
+ itsplit 1
+ acceleration/energy drift too large 5.25026781246343
+ 12.8145055601479 split increased to 2 itime 131232
+ itsplit 1
+ acceleration/energy drift too large 5.66924627720541
+ 13.7051795777903 split increased to 2 itime 132820
+ itsplit 1
+ acceleration/energy drift too large 9.30047742638298
+ 42.8965056797306 split increased to 2 itime 134001
+ itsplit 1
+ acceleration/energy drift too large 6.40026454103283
+ 23.6616223330386 split increased to 2 itime 134848
+ itsplit 1
+ acceleration/energy drift too large 9.97652144920852
+ 66.6077377959504 split increased to 2 itime 135132
+ itsplit 1
+ acceleration/energy drift too large 6.18037926999215
+ 20.7376975255477 split increased to 2 itime 135663
+ itsplit 1
+ acceleration/energy drift too large 2.36662237546351
+ 12.0325046122621 split increased to 2 itime 135782
+ itsplit 1
+ acceleration/energy drift too large 6.04958147857810
+ 12.5633021311993 split increased to 2 itime 136924
+ itsplit 1
+ acceleration/energy drift too large 2.72752027234537
+ 10.0492616001534 split increased to 2 itime 137786
+ itsplit 1
+ acceleration/energy drift too large 3.19111068518775
+ 10.1549536065718 split increased to 2 itime 137810
+ itsplit 1
+ acceleration/energy drift too large 1.89086592180078
+ 10.5430451544192 split increased to 2 itime 137814
+ itsplit 1
+ acceleration/energy drift too large 4.12136106801102
+ 20.6102857463946 split increased to 2 itime 137815
+ itsplit 1
+ acceleration/energy drift too large 4.87297197361513
+ 19.6440491558279 split increased to 2 itime 137817
+ itsplit 1
+ acceleration/energy drift too large 2.52835526322204
+ 10.5464053099332 split increased to 2 itime 137831
+ itsplit 1
+ acceleration/energy drift too large 3.19756769138033
+ 11.1280935247013 split increased to 2 itime 137888
+ itsplit 1
+ acceleration/energy drift too large 3.99239830918571
+ 10.1402887640562 split increased to 2 itime 138109
+ itsplit 1
+ acceleration/energy drift too large 2.85739413532363
+ 10.8498840126343 split increased to 2 itime 138145
+ itsplit 1
+ acceleration/energy drift too large 3.01001304412240
+ 10.0935357908378 split increased to 2 itime 138151
+ itsplit 1
+ acceleration/energy drift too large 8.40595196882248
+ 35.2210040154239 split increased to 2 itime 138705
+ itsplit 1
+ acceleration/energy drift too large 9.45029521403067
+ 51.6979762502821 split increased to 2 itime 139871
+ itsplit 1
+ acceleration/energy drift too large 11.3435110140437
+ 63.6481517928780 split increased to 2 itime 140025
+ itsplit 1
+ acceleration/energy drift too large 6.46366366507642
+ 29.0283242294279 split increased to 2 itime 140521
+ itsplit 1
+ acceleration/energy drift too large 2.61839128387524
+ 11.2550018927665 split increased to 2 itime 140911
+ itsplit 1
+ acceleration/energy drift too large 7.23582151252076
+ 30.2181175613490 split increased to 2 itime 142067
+ itsplit 1
+ acceleration/energy drift too large 10.8814118035559
+ 58.1882935820638 split increased to 2 itime 142112
+ itsplit 1
+ acceleration/energy drift too large 2.21467060360381
+ 10.3990522051491 split increased to 4 itime 142112
+ itsplit 2
+ acceleration/energy drift too large 4.83485506215526
+ 17.9277544046312 split increased to 2 itime 144003
+ itsplit 1
+ acceleration/energy drift too large 2.52754955332185
+ 13.2325347565532 split increased to 2 itime 144145
+ itsplit 1
+ acceleration/energy drift too large 3.87494119558397
+ 12.1417911622164 split increased to 2 itime 145127
+ itsplit 1
+ acceleration/energy drift too large 3.87199279116245
+ 10.0042527945579 split increased to 2 itime 146125
+ itsplit 1
+ acceleration/energy drift too large 5.39897037014481
+ 11.3339401695928 split increased to 2 itime 146822
+ itsplit 1
+ acceleration/energy drift too large 7.42155988182577
+ 25.7613524933781 split increased to 2 itime 147616
+ itsplit 1
+ acceleration/energy drift too large 2.80266149033803
+ 10.9996493261778 split increased to 4 itime 147616
+ itsplit 1
+ acceleration/energy drift too large 7.58973261777039
+ 22.3660152429657 split increased to 2 itime 148058
+ itsplit 1
+ acceleration/energy drift too large 5.17139547861276
+ 19.9634552397798 split increased to 2 itime 148186
+ itsplit 1
+ acceleration/energy drift too large 4.54360168640624
+ 11.0825897451494 split increased to 2 itime 148884
+ itsplit 1
+ acceleration/energy drift too large 4.71375943824704
+ 10.5310501045105 split increased to 2 itime 153003
+ itsplit 1
+ acceleration/energy drift too large 9.65275342432152
+ 34.1717595902119 split increased to 2 itime 156012
+ itsplit 1
+ acceleration/energy drift too large 4.90110384942492
+ 11.6020983825840 split increased to 2 itime 156798
+ itsplit 1
+ acceleration/energy drift too large 5.36852467256297
+ 10.3720766327615 split increased to 2 itime 158530
+ itsplit 1
+ acceleration/energy drift too large 7.40545830393637
+ 14.6747676473396 split increased to 2 itime 160969
+ itsplit 1
+ acceleration/energy drift too large 9.12659927293890
+ 30.6102764859729 split increased to 2 itime 163366
+ itsplit 1
+ acceleration/energy drift too large 2.77722694232665
+ 10.1309552769653 split increased to 2 itime 163511
+ itsplit 1
+ acceleration/energy drift too large 9.50884608565895
+ 42.9729137572448 split increased to 2 itime 163909
+ itsplit 1
+ acceleration/energy drift too large 6.65771366027596
+ 19.8555530628809 split increased to 2 itime 164318
+ itsplit 1
+ acceleration/energy drift too large 5.96820989635850
+ 19.2326239707547 split increased to 2 itime 165220
+ itsplit 1
+ acceleration/energy drift too large 3.67821602103221
+ 17.7580861535272 split increased to 2 itime 167790
+ itsplit 1
+ acceleration/energy drift too large 2.35245705592491
+ 14.8649115573439 split increased to 2 itime 171003
+ itsplit 1
+ acceleration/energy drift too large 3.24018786889419
+ 10.9840237481048 split increased to 2 itime 171349
+ itsplit 1
+ acceleration/energy drift too large 7.00285639505922
+ 23.2267720986572 split increased to 2 itime 173092
+ itsplit 1
+ acceleration/energy drift too large 3.10138324026833
+ 19.6335899775080 split increased to 2 itime 174774
+ itsplit 1
+ acceleration/energy drift too large 5.48712030859221
+ 12.1902891390279 split increased to 2 itime 177748
+ itsplit 1
+ acceleration/energy drift too large 7.39288081134376
+ 25.0252962859053 split increased to 2 itime 178867
+ itsplit 1
+ acceleration/energy drift too large 14.2049630020930
+ 82.4851005368670 split increased to 2 itime 179961
+ itsplit 1
+ acceleration/energy drift too large 12.4992230706220
+ 68.9829023642656 split increased to 2 itime 181396
+ itsplit 1
+ acceleration/energy drift too large 8.21876582046392
+ 22.4354633339393 split increased to 2 itime 182423
+ itsplit 1
+ acceleration/energy drift too large 4.55198593085840
+ 12.4986998366427 split increased to 2 itime 182610
+ itsplit 1
+ acceleration/energy drift too large 1.98471593053076
+ 10.5005773497063 split increased to 2 itime 183272
+ itsplit 1
+ acceleration/energy drift too large 1.84045052411735
+ 10.6382039394232 split increased to 2 itime 183283
+ itsplit 1
+ acceleration/energy drift too large 4.29843197213379
+ 11.2074223052897 split increased to 2 itime 183966
+ itsplit 1
+ acceleration/energy drift too large 5.39826905153061
+ 14.5798751862008 split increased to 2 itime 186530
+ itsplit 1
+ acceleration/energy drift too large 2.87609480268576
+ 11.8710428236899 split increased to 2 itime 186827
+ itsplit 1
+ acceleration/energy drift too large 7.47547233919371
+ 24.0262906498115 split increased to 2 itime 188303
+ itsplit 1
+ acceleration/energy drift too large 10.2406420582556
+ 52.5408665219639 split increased to 2 itime 190866
+ itsplit 1
+ acceleration/energy drift too large 8.41073242555718
+ 32.3241599874662 split increased to 2 itime 191321
+ itsplit 1
+ acceleration/energy drift too large 2.38648582316814
+ 13.2283650440058 split increased to 2 itime 191720
+ itsplit 1
+ acceleration/energy drift too large 3.99432484994876
+ 10.6910181885213 split increased to 2 itime 195038
+ itsplit 1
+ acceleration/energy drift too large 6.45766060344522
+ 11.1633127065760 split increased to 2 itime 195606
+ itsplit 1
+ acceleration/energy drift too large 5.82290105260023
+ 20.4461866223593 split increased to 2 itime 196263
+ itsplit 1
+ acceleration/energy drift too large 9.71023984330179
+ 42.9650712341454 split increased to 2 itime 198720
+ itsplit 1
+ acceleration/energy drift too large 10.1872791579988
+ 52.6925621346871 split increased to 2 itime 199835
+ itsplit 1
+ REMD synchro at 200000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 78.4375000000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.00000 2
+ACC 2 260.00000 1.00000 2
+ACC 3 270.00000 0.50000 2
+ACC 4 280.00000 0.50000 2
+ACC 5 290.00000 0.50000 2
+ACC 6 300.00000 1.00000 2
+ACC 7 310.00000 0.50000 2
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 12.2084485626411
+ 53.6108638583661 split increased to 2 itime 200051
+ itsplit 1
+ acceleration/energy drift too large 2.53810576881656
+ 11.4808941276954 split increased to 4 itime 200051
+ itsplit 2
+ acceleration/energy drift too large 7.55872018123679
+ 29.7927212748254 split increased to 2 itime 201009
+ itsplit 1
+ acceleration/energy drift too large 8.95224165869119
+ 27.8983319151703 split increased to 2 itime 205406
+ itsplit 1
+ acceleration/energy drift too large 9.07098645266622
+ 38.6032995124068 split increased to 2 itime 208750
+ itsplit 1
+ acceleration/energy drift too large 13.1754113330734
+ 90.1809833178590 split increased to 2 itime 208775
+ itsplit 1
+ acceleration/energy drift too large 8.68604181889735
+ 33.4372463370927 split increased to 2 itime 209150
+ itsplit 1
+ acceleration/energy drift too large 2.45260108494234
+ 11.9763295654877 split increased to 2 itime 209568
+ itsplit 1
+ acceleration/energy drift too large 8.33655843070247
+ 23.5659169703030 split increased to 2 itime 210592
+ itsplit 1
+ acceleration/energy drift too large 6.40284348209486
+ 18.2833200959135 split increased to 2 itime 215211
+ itsplit 1
+ acceleration/energy drift too large 15.3435710635003
+ 106.134828552885 split increased to 2 itime 215759
+ itsplit 1
+ acceleration/energy drift too large 7.72564258503192
+ 29.2105405852435 split increased to 2 itime 216380
+ itsplit 1
+ acceleration/energy drift too large 8.03076727820753
+ 33.8398247413509 split increased to 2 itime 217032
+ itsplit 1
+ acceleration/energy drift too large 1.79885122075765
+ 14.6974936613242 split increased to 2 itime 217033
+ itsplit 1
+ acceleration/energy drift too large 3.42984444970851
+ 25.4748699041339 split increased to 2 itime 217766
+ itsplit 1
+ acceleration/energy drift too large 9.92133896073913
+ 46.1141390371501 split increased to 2 itime 220551
+ itsplit 1
+ acceleration/energy drift too large 3.86581732121221
+ 12.6818810062393 split increased to 2 itime 225885
+ itsplit 1
+ acceleration/energy drift too large 4.75556207989291
+ 23.7514322447296 split increased to 2 itime 229101
+ itsplit 1
+ acceleration/energy drift too large 5.96454573739078
+ 15.1323178318082 split increased to 2 itime 230540
+ itsplit 1
+ acceleration/energy drift too large 3.42487620865555
+ 10.3721888933533 split increased to 2 itime 231526
+ itsplit 1
+ acceleration/energy drift too large 3.98801109571964
+ 16.1502365642523 split increased to 2 itime 232127
+ itsplit 1
+ acceleration/energy drift too large 7.08469640313974
+ 23.1904142397815 split increased to 2 itime 234644
+ itsplit 1
+ acceleration/energy drift too large 4.93775003788783
+ 26.3669011701329 split increased to 2 itime 238322
+ itsplit 1
+ acceleration/energy drift too large 2.86865279559611
+ 11.8612338762924 split increased to 2 itime 238780
+ itsplit 1
+ acceleration/energy drift too large 14.9987157615550
+ 96.2927253197508 split increased to 2 itime 242801
+ itsplit 1
+ acceleration/energy drift too large 11.1887830328447
+ 52.7840892820987 split increased to 2 itime 244036
+ itsplit 1
+ acceleration/energy drift too large 2.17365828266367
+ 19.5481246997944 split increased to 2 itime 246615
+ itsplit 1
+ acceleration/energy drift too large 1.74346672463242
+ 10.2694527887976 split increased to 2 itime 246620
+ itsplit 1
+ acceleration/energy drift too large 13.6510241983959
+ 84.0580108248525 split increased to 2 itime 249654
+ itsplit 1
+ acceleration/energy drift too large 4.66616138520528
+ 15.2142327775412 split increased to 2 itime 250520
+ itsplit 1
+ acceleration/energy drift too large 6.99562401956982
+ 22.8419897904330 split increased to 2 itime 251418
+ itsplit 1
+ acceleration/energy drift too large 3.99280691445085
+ 28.2701787869753 split increased to 2 itime 254716
+ itsplit 1
+ acceleration/energy drift too large 2.38701850151646
+ 10.4971632893545 split increased to 2 itime 256229
+ itsplit 1
+ acceleration/energy drift too large 6.29779030790586
+ 25.8730097264853 split increased to 2 itime 258121
+ itsplit 1
+ acceleration/energy drift too large 7.44525875256638
+ 39.3836564068932 split increased to 2 itime 258707
+ itsplit 1
+ acceleration/energy drift too large 12.4135413288451
+ 55.5102788257445 split increased to 2 itime 259403
+ itsplit 1
+ acceleration/energy drift too large 2.65543237745000
+ 12.0025509471393 split increased to 2 itime 265674
+ itsplit 1
+ acceleration/energy drift too large 2.06613873680979
+ 12.2617485722993 split increased to 2 itime 265681
+ itsplit 1
+ acceleration/energy drift too large 3.13762773440860
+ 10.8292687716040 split increased to 2 itime 265683
+ itsplit 1
+ acceleration/energy drift too large 2.81285555564065
+ 10.9593771113962 split increased to 2 itime 265692
+ itsplit 1
+ acceleration/energy drift too large 3.38952210418907
+ 14.0784694161536 split increased to 2 itime 265890
+ itsplit 1
+ acceleration/energy drift too large 11.1001329471798
+ 51.8536583414426 split increased to 2 itime 266749
+ itsplit 1
+ acceleration/energy drift too large 7.80939107915785
+ 22.7586465545398 split increased to 2 itime 267371
+ itsplit 1
+ acceleration/energy drift too large 4.33983222209805
+ 12.2111350298332 split increased to 2 itime 270506
+ itsplit 1
+ acceleration/energy drift too large 3.63291128698837
+ 10.1576368425821 split increased to 2 itime 271178
+ itsplit 1
+ acceleration/energy drift too large 2.54247680609218
+ 10.1803463167128 split increased to 2 itime 274561
+ itsplit 1
+ acceleration/energy drift too large 3.07126177362703
+ 10.0445037538388 split increased to 2 itime 274693
+ itsplit 1
+ acceleration/energy drift too large 2.49757231335019
+ 10.2344073261167 split increased to 2 itime 274758
+ itsplit 1
+ acceleration/energy drift too large 5.49775122601844
+ 13.2721919813381 split increased to 2 itime 280580
+ itsplit 1
+ acceleration/energy drift too large 5.01330379975365
+ 18.6797560492280 split increased to 2 itime 281897
+ itsplit 1
+ acceleration/energy drift too large 2.19453561861262
+ 10.1661175165272 split increased to 2 itime 283308
+ itsplit 1
+ acceleration/energy drift too large 4.19230346213308
+ 13.7416301125946 split increased to 2 itime 283534
+ itsplit 1
+ acceleration/energy drift too large 10.7575306802793
+ 56.2501450627783 split increased to 2 itime 291227
+ itsplit 1
+ acceleration/energy drift too large 4.70277060063352
+ 11.0147728582671 split increased to 2 itime 291642
+ itsplit 1
+ acceleration/energy drift too large 6.06761348131801
+ 19.5350047137485 split increased to 2 itime 292810
+ itsplit 1
+ acceleration/energy drift too large 2.45355661794724
+ 10.0668239644584 split increased to 2 itime 299351
+ itsplit 1
+ acceleration/energy drift too large 2.61841955106773
+ 10.9013641768885 split increased to 2 itime 299463
+ itsplit 1
+ acceleration/energy drift too large 2.64006131933536
+ 17.3861906171351 split increased to 2 itime 299880
+ itsplit 1
+ REMD synchro at 300000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 118.109375000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 0.000000000000000E+000
+ NREP 16
+ACC 1 250.00000 0.00000 3
+ACC 2 260.00000 1.00000 3
+ACC 3 270.00000 0.66667 3
+ACC 4 280.00000 0.33333 3
+ACC 5 290.00000 0.66667 3
+ACC 6 300.00000 1.00000 3
+ACC 7 310.00000 0.33333 3
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 0.000000000000000E+000
+ acceleration/energy drift too large 4.72793967015098
+ 15.1752628844156 split increased to 2 itime 300756
+ itsplit 1
+ acceleration/energy drift too large 4.66040627613142
+ 23.4182183203648 split increased to 2 itime 300911
+ itsplit 1
+ acceleration/energy drift too large 3.61596973682947
+ 15.0953045151588 split increased to 2 itime 301915
+ itsplit 1
+ acceleration/energy drift too large 3.66210427036869
+ 14.2418825586096 split increased to 2 itime 303554
+ itsplit 1
+ acceleration/energy drift too large 4.67370280541112
+ 18.8431776909442 split increased to 2 itime 304417
+ itsplit 1
+ acceleration/energy drift too large 1.45602157451694
+ 16.2795388291869 split increased to 2 itime 304418
+ itsplit 1
+ acceleration/energy drift too large 2.99435547775342
+ 11.7038953281149 split increased to 2 itime 304584
+ itsplit 1
+ acceleration/energy drift too large 11.0831346111954
+ 58.0964280669970 split increased to 2 itime 311730
+ itsplit 1
+ acceleration/energy drift too large 4.81510104681937
+ 17.8281621572103 split increased to 2 itime 314056
+ itsplit 1
+ acceleration/energy drift too large 6.40786411222459
+ 22.9634805792219 split increased to 2 itime 316288
+ itsplit 1
+ acceleration/energy drift too large 7.54219908503625
+ 25.5996617916688 split increased to 2 itime 317694
+ itsplit 1
+ acceleration/energy drift too large 2.09454046209944
+ 10.2517218977358 split increased to 2 itime 320285
+ itsplit 1
+ acceleration/energy drift too large 4.80102152897987
+ 29.9677296310039 split increased to 2 itime 325606
+ itsplit 1
+ acceleration/energy drift too large 3.56737180697507
+ 20.2125978686371 split increased to 2 itime 326037
+ itsplit 1
+ acceleration/energy drift too large 7.22713320417288
+ 22.2475233785378 split increased to 2 itime 329471
+ itsplit 1
+ acceleration/energy drift too large 6.82800698438666
+ 20.7980271650654 split increased to 2 itime 334536
+ itsplit 1
+ acceleration/energy drift too large 4.96338155418168
+ 12.4474381848688 split increased to 2 itime 335036
+ itsplit 1
+ acceleration/energy drift too large 4.53507186381455
+ 14.2045366308279 split increased to 2 itime 335677
+ itsplit 1
+ acceleration/energy drift too large 4.62972647630605
+ 12.5550411995306 split increased to 2 itime 336192
+ itsplit 1
+ acceleration/energy drift too large 6.06755998182457
+ 27.8886634979340 split increased to 2 itime 336238
+ itsplit 1
+ acceleration/energy drift too large 2.83496922734442
+ 12.0452628164488 split increased to 2 itime 341105
+ itsplit 1
+ acceleration/energy drift too large 5.70499867575682
+ 18.6330729513646 split increased to 2 itime 341729
+ itsplit 1
+ acceleration/energy drift too large 10.2509021064175
+ 54.3307812079466 split increased to 2 itime 343627
+ itsplit 1
+ acceleration/energy drift too large 4.53567379925911
+ 15.5787465032927 split increased to 2 itime 344765
+ itsplit 1
+ acceleration/energy drift too large 2.34910412647582
+ 11.4066831717411 split increased to 2 itime 345135
+ itsplit 1
+ acceleration/energy drift too large 3.34112593912448
+ 12.3503628231198 split increased to 2 itime 345809
+ itsplit 1
+ acceleration/energy drift too large 3.92054093281767
+ 10.3619888680073 split increased to 2 itime 345957
+ itsplit 1
+ acceleration/energy drift too large 4.60188697922431
+ 13.5374110552558 split increased to 2 itime 346379
+ itsplit 1
+ acceleration/energy drift too large 3.72544866392539
+ 10.3183611689152 split increased to 2 itime 347557
+ itsplit 1
+ acceleration/energy drift too large 5.06628129110537
+ 11.1652123159367 split increased to 2 itime 348951
+ itsplit 1
+ acceleration/energy drift too large 4.16072166864979
+ 18.9931939795688 split increased to 2 itime 349363
+ itsplit 1
+ acceleration/energy drift too large 2.29507012800224
+ 10.9139930650483 split increased to 2 itime 350122
+ itsplit 1
+ acceleration/energy drift too large 4.29322202576090
+ 10.9735591274698 split increased to 2 itime 350795
+ itsplit 1
+ acceleration/energy drift too large 9.82286353074248
+ 44.0750951110660 split increased to 2 itime 351103
+ itsplit 1
+ acceleration/energy drift too large 4.08168175575937
+ 18.9210472126944 split increased to 2 itime 356037
+ itsplit 1
+ acceleration/energy drift too large 3.90699506859462
+ 10.1145620328750 split increased to 2 itime 357297
+ itsplit 1
+ acceleration/energy drift too large 4.45667366680077
+ 13.1513532966716 split increased to 2 itime 357386
+ itsplit 1
+ acceleration/energy drift too large 2.93896860614967
+ 10.9492343401078 split increased to 2 itime 357539
+ itsplit 1
+ acceleration/energy drift too large 4.19998924610281
+ 11.3378070198131 split increased to 2 itime 357603
+ itsplit 1
+ acceleration/energy drift too large 6.87404532260868
+ 16.8515227764894 split increased to 2 itime 358947
+ itsplit 1
+ acceleration/energy drift too large 5.27316141157960
+ 24.1435435160295 split increased to 2 itime 361684
+ itsplit 1
+ acceleration/energy drift too large 4.47229702050832
+ 13.4202958101381 split increased to 2 itime 368819
+ itsplit 1
+ acceleration/energy drift too large 6.25758447509473
+ 18.9183394314035 split increased to 2 itime 369261
+ itsplit 1
+ acceleration/energy drift too large 6.12288706322436
+ 36.7787192796118 split increased to 2 itime 371873
+ itsplit 1
+ acceleration/energy drift too large 2.71939078146220
+ 10.6363014882108 split increased to 2 itime 376517
+ itsplit 1
+ acceleration/energy drift too large 4.02947389765559
+ 10.1322742203006 split increased to 2 itime 376527
+ itsplit 1
+ acceleration/energy drift too large 5.60607543290980
+ 22.8571536437450 split increased to 2 itime 377009
+ itsplit 1
+ acceleration/energy drift too large 5.08356101092109
+ 11.2211356159098 split increased to 2 itime 377568
+ itsplit 1
+ acceleration/energy drift too large 4.69946442072449
+ 13.9777696212737 split increased to 2 itime 381318
+ itsplit 1
+ acceleration/energy drift too large 9.34069644899130
+ 34.0555605910648 split increased to 2 itime 383493
+ itsplit 1
+ acceleration/energy drift too large 6.27248498501550
+ 10.4039078718275 split increased to 2 itime 390244
+ itsplit 1
+ acceleration/energy drift too large 6.52577007005597
+ 26.6490801364831 split increased to 2 itime 390544
+ itsplit 1
+ acceleration/energy drift too large 5.41096965651657
+ 19.4284264358583 split increased to 2 itime 391032
+ itsplit 1
+ acceleration/energy drift too large 9.65886191056836
+ 33.8381494710579 split increased to 2 itime 393221
+ itsplit 1
+ acceleration/energy drift too large 11.9468472090546
+ 82.4751608104003 split increased to 2 itime 393729
+ itsplit 1
+ acceleration/energy drift too large 10.4699304006037
+ 58.5649932729230 split increased to 2 itime 394997
+ itsplit 1
+ acceleration/energy drift too large 2.20445882038501
+ 10.9818511065717 split increased to 2 itime 396057
+ itsplit 1
+ acceleration/energy drift too large 8.06703128456995
+ 30.8844960251752 split increased to 2 itime 397072
+ itsplit 1
+ acceleration/energy drift too large 6.72810857639519
+ 23.1823116638008 split increased to 2 itime 398147
+ itsplit 1
+ REMD synchro at 400000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 157.765625000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.00000 4
+ACC 2 260.00000 1.00000 4
+ACC 3 270.00000 0.50000 4
+ACC 4 280.00000 0.25000 4
+ACC 5 290.00000 0.75000 4
+ACC 6 300.00000 1.00000 4
+ACC 7 310.00000 0.50000 4
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 6.76528137629433
+ 18.9152164268437 split increased to 2 itime 400595
+ itsplit 1
+ acceleration/energy drift too large 6.35716823717715
+ 22.3062693248204 split increased to 2 itime 400699
+ itsplit 1
+ acceleration/energy drift too large 7.84809751161058
+ 21.2742956213607 split increased to 2 itime 401493
+ itsplit 1
+ acceleration/energy drift too large 11.4558871023131
+ 62.8925907237390 split increased to 2 itime 401804
+ itsplit 1
+ acceleration/energy drift too large 7.22266505466903
+ 20.7052003144113 split increased to 2 itime 401902
+ itsplit 1
+ acceleration/energy drift too large 6.37515539426735
+ 14.6428901601758 split increased to 2 itime 403244
+ itsplit 1
+ acceleration/energy drift too large 3.16725001786478
+ 11.2539011497379 split increased to 2 itime 406744
+ itsplit 1
+ acceleration/energy drift too large 3.62993852531751
+ 31.3732987741173 split increased to 2 itime 410866
+ itsplit 1
+ acceleration/energy drift too large 5.41633694707513
+ 17.8770337551578 split increased to 2 itime 411286
+ itsplit 1
+ acceleration/energy drift too large 2.46400733597370
+ 15.6735292023452 split increased to 2 itime 412255
+ itsplit 1
+ acceleration/energy drift too large 5.53308107445780
+ 17.4155467837664 split increased to 2 itime 415799
+ itsplit 1
+ acceleration/energy drift too large 5.94983636372315
+ 15.9623114605275 split increased to 2 itime 416125
+ itsplit 1
+ acceleration/energy drift too large 8.67810320012529
+ 29.0968437798901 split increased to 2 itime 417402
+ itsplit 1
+ acceleration/energy drift too large 4.35569399050208
+ 11.7334556399489 split increased to 2 itime 417622
+ itsplit 1
+ acceleration/energy drift too large 3.30596955710362
+ 10.3409002377787 split increased to 2 itime 418656
+ itsplit 1
+ acceleration/energy drift too large 4.93867457636622
+ 10.6515985115818 split increased to 2 itime 419477
+ itsplit 1
+ acceleration/energy drift too large 3.91663018910074
+ 23.3003716403585 split increased to 2 itime 420627
+ itsplit 1
+ acceleration/energy drift too large 7.96978572029989
+ 28.4042731793131 split increased to 2 itime 424491
+ itsplit 1
+ acceleration/energy drift too large 4.48312086924299
+ 10.8838591539524 split increased to 2 itime 424548
+ itsplit 1
+ acceleration/energy drift too large 5.20276394284693
+ 15.5571360489642 split increased to 2 itime 428294
+ itsplit 1
+ acceleration/energy drift too large 11.9895150656543
+ 68.2021702707443 split increased to 2 itime 429107
+ itsplit 1
+ acceleration/energy drift too large 3.54220051490668
+ 10.4024163466329 split increased to 2 itime 429115
+ itsplit 1
+ acceleration/energy drift too large 2.69599872727365
+ 10.7305518426037 split increased to 2 itime 429134
+ itsplit 1
+ acceleration/energy drift too large 1.54786601754391
+ 10.9032473998093 split increased to 2 itime 431099
+ itsplit 1
+ acceleration/energy drift too large 7.63630639282310
+ 13.8009359657687 split increased to 2 itime 436405
+ itsplit 1
+ acceleration/energy drift too large 2.51122897290491
+ 11.8305425090823 split increased to 2 itime 440551
+ itsplit 1
+ acceleration/energy drift too large 2.72166804342636
+ 11.2495723220724 split increased to 2 itime 440605
+ itsplit 1
+ acceleration/energy drift too large 8.58877959848657
+ 33.3066132338974 split increased to 2 itime 440685
+ itsplit 1
+ acceleration/energy drift too large 6.33750986692049
+ 19.1689970666315 split increased to 2 itime 440738
+ itsplit 1
+ acceleration/energy drift too large 2.79915952607211
+ 19.5073471065654 split increased to 2 itime 442200
+ itsplit 1
+ acceleration/energy drift too large 3.69702427548960
+ 14.8047535374368 split increased to 2 itime 442201
+ itsplit 1
+ acceleration/energy drift too large 2.67479726465997
+ 10.7673797010477 split increased to 2 itime 442302
+ itsplit 1
+ acceleration/energy drift too large 1.76317474317928
+ 11.1030106400444 split increased to 2 itime 443059
+ itsplit 1
+ acceleration/energy drift too large 3.96725090425869
+ 33.2671258782010 split increased to 2 itime 443223
+ itsplit 1
+ acceleration/energy drift too large 1.99657748054833
+ 10.9742134976835 split increased to 2 itime 446835
+ itsplit 1
+ acceleration/energy drift too large 4.92437873951666
+ 12.3199097274015 split increased to 2 itime 447236
+ itsplit 1
+ acceleration/energy drift too large 7.81784117413882
+ 27.1356400374625 split increased to 2 itime 447913
+ itsplit 1
+ acceleration/energy drift too large 2.66934366627334
+ 10.4915529948296 split increased to 2 itime 448803
+ itsplit 1
+ acceleration/energy drift too large 8.07905592534353
+ 37.3855141278889 split increased to 2 itime 450743
+ itsplit 1
+ acceleration/energy drift too large 5.23840632032607
+ 12.3565337729949 split increased to 2 itime 455141
+ itsplit 1
+ acceleration/energy drift too large 1.52507795198408
+ 17.2799920842790 split increased to 2 itime 456808
+ itsplit 1
+ acceleration/energy drift too large 12.7657768637565
+ 64.7909622775309 split increased to 2 itime 457747
+ itsplit 1
+ acceleration/energy drift too large 3.33487566661482
+ 10.1332690372463 split increased to 2 itime 458191
+ itsplit 1
+ acceleration/energy drift too large 5.51042171311435
+ 16.6632476738072 split increased to 2 itime 459182
+ itsplit 1
+ acceleration/energy drift too large 7.48058882220526
+ 25.5950893777778 split increased to 2 itime 459619
+ itsplit 1
+ acceleration/energy drift too large 6.12341381013875
+ 19.0354985676417 split increased to 2 itime 462589
+ itsplit 1
+ acceleration/energy drift too large 3.33172805964860
+ 19.0486627654567 split increased to 2 itime 462613
+ itsplit 1
+ acceleration/energy drift too large 5.92891045235391
+ 17.5473584248474 split increased to 2 itime 463149
+ itsplit 1
+ acceleration/energy drift too large 3.40840410584659
+ 10.2156551066010 split increased to 2 itime 463285
+ itsplit 1
+ acceleration/energy drift too large 9.30094460396799
+ 39.0892939049737 split increased to 2 itime 463541
+ itsplit 1
+ acceleration/energy drift too large 4.65707318395544
+ 11.2117054420582 split increased to 2 itime 464281
+ itsplit 1
+ acceleration/energy drift too large 2.20965772608548
+ 10.2683540118625 split increased to 2 itime 466139
+ itsplit 1
+ acceleration/energy drift too large 4.17932083821145
+ 10.4065741232833 split increased to 2 itime 476085
+ itsplit 1
+ acceleration/energy drift too large 7.84940588562164
+ 30.5183689193394 split increased to 2 itime 476144
+ itsplit 1
+ acceleration/energy drift too large 8.11452023297231
+ 31.9023003444632 split increased to 2 itime 480400
+ itsplit 1
+ acceleration/energy drift too large 4.59919596486169
+ 11.4657765327672 split increased to 2 itime 481016
+ itsplit 1
+ acceleration/energy drift too large 6.69913238415660
+ 24.5262799740877 split increased to 2 itime 482369
+ itsplit 1
+ acceleration/energy drift too large 2.80257553068563
+ 13.3756754786089 split increased to 2 itime 482422
+ itsplit 1
+ acceleration/energy drift too large 8.34424220263782
+ 34.0555270237589 split increased to 2 itime 482496
+ itsplit 1
+ acceleration/energy drift too large 9.89802922063932
+ 46.7905628492208 split increased to 2 itime 482786
+ itsplit 1
+ acceleration/energy drift too large 14.7486480514098
+ 82.2416743122557 split increased to 2 itime 485237
+ itsplit 1
+ acceleration/energy drift too large 10.9918933227943
+ 48.2171417205249 split increased to 2 itime 488387
+ itsplit 1
+ acceleration/energy drift too large 13.5248934694627
+ 84.6187689370187 split increased to 2 itime 491024
+ itsplit 1
+ acceleration/energy drift too large 5.12004566117031
+ 12.5006640685325 split increased to 2 itime 491217
+ itsplit 1
+ acceleration/energy drift too large 4.62378699181046
+ 15.7359452150762 split increased to 2 itime 494842
+ itsplit 1
+ acceleration/energy drift too large 1.94131773374966
+ 10.6642856388911 split increased to 2 itime 495263
+ itsplit 1
+ acceleration/energy drift too large 4.53882651100607
+ 11.0913514520934 split increased to 2 itime 496963
+ itsplit 1
+ acceleration/energy drift too large 7.46393772452495
+ 22.0642266192114 split increased to 2 itime 497257
+ itsplit 1
+ REMD synchro at 500000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 197.445312500000 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 5
+ACC 2 260.00000 1.00000 5
+ACC 3 270.00000 0.40000 5
+ACC 4 280.00000 0.40000 5
+ACC 5 290.00000 0.60000 5
+ACC 6 300.00000 1.00000 5
+ACC 7 310.00000 0.40000 5
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 7.50900403416654
+ 27.5446702958400 split increased to 2 itime 501014
+ itsplit 1
+ acceleration/energy drift too large 4.17725480895850
+ 16.5702840974671 split increased to 2 itime 502332
+ itsplit 1
+ acceleration/energy drift too large 6.07618123970452
+ 16.2153805601781 split increased to 2 itime 508590
+ itsplit 1
+ acceleration/energy drift too large 5.70606727506766
+ 20.5520815829891 split increased to 2 itime 509010
+ itsplit 1
+ acceleration/energy drift too large 6.72570158634208
+ 16.4640984868293 split increased to 2 itime 509786
+ itsplit 1
+ acceleration/energy drift too large 4.53506047192253
+ 13.0484215372048 split increased to 2 itime 510538
+ itsplit 1
+ acceleration/energy drift too large 1.87811346239179
+ 10.3978009288242 split increased to 2 itime 511753
+ itsplit 1
+ acceleration/energy drift too large 5.19686138921645
+ 14.4934502883267 split increased to 2 itime 512188
+ itsplit 1
+ acceleration/energy drift too large 8.60220207215693
+ 32.4842881295725 split increased to 2 itime 514390
+ itsplit 1
+ acceleration/energy drift too large 5.83605475997747
+ 18.7719989795466 split increased to 2 itime 514516
+ itsplit 1
+ acceleration/energy drift too large 2.05216156218067
+ 13.1325218209728 split increased to 2 itime 515487
+ itsplit 1
+ acceleration/energy drift too large 4.83151104409780
+ 15.6556824051344 split increased to 2 itime 517886
+ itsplit 1
+ acceleration/energy drift too large 8.90677205774902
+ 13.2991113522715 split increased to 2 itime 518470
+ itsplit 1
+ acceleration/energy drift too large 1.55873228437365
+ 12.0513858644168 split increased to 2 itime 520971
+ itsplit 1
+ acceleration/energy drift too large 7.99757097323012
+ 30.8828168917488 split increased to 2 itime 521609
+ itsplit 1
+ acceleration/energy drift too large 3.52049942844456
+ 18.8951828831860 split increased to 2 itime 522108
+ itsplit 1
+ acceleration/energy drift too large 4.93743449703613
+ 17.9454216587535 split increased to 2 itime 523546
+ itsplit 1
+ acceleration/energy drift too large 2.79201637010132
+ 24.2223230662151 split increased to 2 itime 524775
+ itsplit 1
+ acceleration/energy drift too large 6.47990626841869
+ 36.2402149933173 split increased to 2 itime 525363
+ itsplit 1
+ acceleration/energy drift too large 4.88856873583990
+ 12.3650472445267 split increased to 2 itime 527272
+ itsplit 1
+ acceleration/energy drift too large 6.16379767003773
+ 21.8070799438585 split increased to 2 itime 527301
+ itsplit 1
+ acceleration/energy drift too large 4.97636809161150
+ 11.8041846185277 split increased to 2 itime 527353
+ itsplit 1
+ acceleration/energy drift too large 9.55099015129207
+ 42.2847404202911 split increased to 2 itime 528247
+ itsplit 1
+ acceleration/energy drift too large 3.47427601801362
+ 10.1565218321010 split increased to 2 itime 529135
+ itsplit 1
+ acceleration/energy drift too large 5.96113520468168
+ 14.8429759199479 split increased to 2 itime 529457
+ itsplit 1
+ acceleration/energy drift too large 8.13103043172691
+ 28.0486466013811 split increased to 2 itime 529548
+ itsplit 1
+ acceleration/energy drift too large 7.68241904278665
+ 27.3133029302084 split increased to 2 itime 530307
+ itsplit 1
+ acceleration/energy drift too large 3.11642780074165
+ 10.5219589054614 split increased to 2 itime 530323
+ itsplit 1
+ acceleration/energy drift too large 2.02144803008016
+ 11.4790652715456 split increased to 2 itime 530325
+ itsplit 1
+ acceleration/energy drift too large 2.29682887329730
+ 14.7605803097151 split increased to 2 itime 532731
+ itsplit 1
+ acceleration/energy drift too large 8.19520495969552
+ 28.5654973088707 split increased to 2 itime 532780
+ itsplit 1
+ acceleration/energy drift too large 4.05476930810241
+ 11.3930943167692 split increased to 2 itime 534942
+ itsplit 1
+ acceleration/energy drift too large 10.3642150714910
+ 53.6221261442702 split increased to 2 itime 538600
+ itsplit 1
+ acceleration/energy drift too large 4.78560840039094
+ 10.3408445630894 split increased to 2 itime 541784
+ itsplit 1
+ acceleration/energy drift too large 6.31930777616046
+ 22.4948240815235 split increased to 2 itime 546755
+ itsplit 1
+ acceleration/energy drift too large 7.79044231117698
+ 30.4068529368244 split increased to 2 itime 548082
+ itsplit 1
+ acceleration/energy drift too large 2.50625057638106
+ 12.3065710978013 split increased to 2 itime 549302
+ itsplit 1
+ acceleration/energy drift too large 3.29112150249386
+ 10.3748523901260 split increased to 2 itime 549748
+ itsplit 1
+ acceleration/energy drift too large 8.20055199987064
+ 33.6536206544168 split increased to 2 itime 551042
+ itsplit 1
+ acceleration/energy drift too large 4.23522658046993
+ 14.7884631941625 split increased to 2 itime 556278
+ itsplit 1
+ acceleration/energy drift too large 5.68944954689445
+ 35.9193089656826 split increased to 2 itime 557135
+ itsplit 1
+ acceleration/energy drift too large 6.21365084988955
+ 17.9957887195218 split increased to 2 itime 557750
+ itsplit 1
+ acceleration/energy drift too large 2.25582035030492
+ 11.4193003567222 split increased to 2 itime 558642
+ itsplit 1
+ acceleration/energy drift too large 13.5317692717754
+ 79.0834859515207 split increased to 2 itime 560207
+ itsplit 1
+ acceleration/energy drift too large 2.52404544420669
+ 11.1503300947159 split increased to 4 itime 560207
+ itsplit 1
+ acceleration/energy drift too large 5.69416189719272
+ 12.5795838067874 split increased to 2 itime 566902
+ itsplit 1
+ acceleration/energy drift too large 5.73126540227734
+ 10.6350922275790 split increased to 2 itime 567690
+ itsplit 1
+ acceleration/energy drift too large 2.90765212451102
+ 15.5761231645314 split increased to 2 itime 567695
+ itsplit 1
+ acceleration/energy drift too large 11.5885351457228
+ 58.8666841095515 split increased to 2 itime 567900
+ itsplit 1
+ acceleration/energy drift too large 2.12757217708945
+ 13.0872110744824 split increased to 2 itime 571361
+ itsplit 1
+ acceleration/energy drift too large 8.69640960950267
+ 37.9694952926861 split increased to 2 itime 571785
+ itsplit 1
+ acceleration/energy drift too large 5.68034348404928
+ 19.8833474102247 split increased to 2 itime 574060
+ itsplit 1
+ acceleration/energy drift too large 3.72877291300232
+ 12.5902366796661 split increased to 2 itime 574597
+ itsplit 1
+ acceleration/energy drift too large 3.57608189291435
+ 13.0454019801732 split increased to 2 itime 578281
+ itsplit 1
+ acceleration/energy drift too large 5.33415794604788
+ 22.7449980891698 split increased to 2 itime 579693
+ itsplit 1
+ acceleration/energy drift too large 3.06973229604473
+ 22.3495355826886 split increased to 2 itime 581686
+ itsplit 1
+ acceleration/energy drift too large 6.24898956712644
+ 21.3035538708782 split increased to 2 itime 582487
+ itsplit 1
+ acceleration/energy drift too large 5.19134079220393
+ 10.9790768794968 split increased to 2 itime 582656
+ itsplit 1
+ acceleration/energy drift too large 6.80197608164520
+ 29.3999508366813 split increased to 2 itime 583899
+ itsplit 1
+ acceleration/energy drift too large 3.17695027724316
+ 10.5313182869027 split increased to 2 itime 585507
+ itsplit 1
+ acceleration/energy drift too large 1.59906457598754
+ 12.1399017422161 split increased to 2 itime 586237
+ itsplit 1
+ acceleration/energy drift too large 1.72651279818246
+ 12.4840963225588 split increased to 2 itime 586357
+ itsplit 1
+ acceleration/energy drift too large 5.34385290161771
+ 11.2362647432214 split increased to 2 itime 589286
+ itsplit 1
+ acceleration/energy drift too large 8.30516435779183
+ 25.9971879374983 split increased to 2 itime 589804
+ itsplit 1
+ acceleration/energy drift too large 4.88846891091825
+ 10.0939699741975 split increased to 2 itime 589999
+ itsplit 1
+ acceleration/energy drift too large 2.58282828753721
+ 10.4085396105576 split increased to 2 itime 590004
+ itsplit 1
+ acceleration/energy drift too large 4.66440413772390
+ 11.2421302629400 split increased to 2 itime 590374
+ itsplit 1
+ acceleration/energy drift too large 17.3948840685740
+ 102.625829844118 split increased to 2 itime 590925
+ itsplit 1
+ acceleration/energy drift too large 3.71413260669478
+ 20.6170389786129 split increased to 4 itime 590925
+ itsplit 2
+ acceleration/energy drift too large 5.51494013469141
+ 16.0336040785288 split increased to 2 itime 592224
+ itsplit 1
+ acceleration/energy drift too large 4.45216777613609
+ 10.0183789134888 split increased to 2 itime 592225
+ itsplit 1
+ acceleration/energy drift too large 3.10040440846196
+ 10.3541903991900 split increased to 2 itime 592563
+ itsplit 1
+ acceleration/energy drift too large 5.36627123022187
+ 10.2780892272313 split increased to 2 itime 595104
+ itsplit 1
+ acceleration/energy drift too large 2.44173381520636
+ 13.8192908210974 split increased to 2 itime 595446
+ itsplit 1
+ acceleration/energy drift too large 9.69263911904402
+ 44.3222562049126 split increased to 2 itime 597435
+ itsplit 1
+ acceleration/energy drift too large 12.0335115752171
+ 57.6104710240538 split increased to 2 itime 598577
+ itsplit 1
+ acceleration/energy drift too large 2.79641289552280
+ 13.4043077783830 split increased to 4 itime 598577
+ itsplit 2
+ acceleration/energy drift too large 2.22726855821489
+ 10.1267312261811 split increased to 2 itime 599309
+ itsplit 1
+ REMD synchro at 600000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 237.109375000000 0.000000000000000E+000
+ REMD writing rst time= 3.906250000000000E-003
+ REMD writing traj time= 0.000000000000000E+000
+ NREP 16
+ACC 1 250.00000 0.16667 6
+ACC 2 260.00000 1.00000 6
+ACC 3 270.00000 0.33333 6
+ACC 4 280.00000 0.50000 6
+ACC 5 290.00000 0.66667 6
+ACC 6 300.00000 1.00000 6
+ACC 7 310.00000 0.50000 6
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 5.58546343444704
+ 15.0548641884903 split increased to 2 itime 601878
+ itsplit 1
+ acceleration/energy drift too large 5.52809146262567
+ 17.4916928437900 split increased to 2 itime 602411
+ itsplit 1
+ acceleration/energy drift too large 5.27520661432915
+ 28.4260245745983 split increased to 2 itime 604903
+ itsplit 1
+ acceleration/energy drift too large 10.7091604673618
+ 48.6458205610094 split increased to 2 itime 605354
+ itsplit 1
+ acceleration/energy drift too large 13.3983519341439
+ 68.9624238506460 split increased to 2 itime 605983
+ itsplit 1
+ acceleration/energy drift too large 3.16205608757604
+ 15.4900686421038 split increased to 4 itime 605983
+ itsplit 2
+ acceleration/energy drift too large 2.66091884482526
+ 13.3206883662034 split increased to 2 itime 606006
+ itsplit 1
+ acceleration/energy drift too large 6.08358463547764
+ 27.1217834383387 split increased to 2 itime 609632
+ itsplit 1
+ acceleration/energy drift too large 6.25250056843083
+ 11.4491403874430 split increased to 2 itime 609684
+ itsplit 1
+ acceleration/energy drift too large 4.83622938333850
+ 13.0407062469096 split increased to 2 itime 610728
+ itsplit 1
+ acceleration/energy drift too large 2.95605734475806
+ 11.9787969223421 split increased to 2 itime 611550
+ itsplit 1
+ acceleration/energy drift too large 13.4930954611733
+ 73.9062338473796 split increased to 2 itime 614180
+ itsplit 1
+ acceleration/energy drift too large 2.91153716177087
+ 15.8821454416596 split increased to 4 itime 614180
+ itsplit 2
+ acceleration/energy drift too large 4.06572241737329
+ 11.8108467775741 split increased to 2 itime 615925
+ itsplit 1
+ acceleration/energy drift too large 2.62647171683830
+ 13.0013702410149 split increased to 2 itime 616220
+ itsplit 1
+ acceleration/energy drift too large 4.05099726855354
+ 11.3958267635391 split increased to 2 itime 616626
+ itsplit 1
+ acceleration/energy drift too large 4.16491863219391
+ 10.6155862426420 split increased to 2 itime 618680
+ itsplit 1
+ acceleration/energy drift too large 2.41942223273229
+ 10.9988570424266 split increased to 2 itime 622690
+ itsplit 1
+ acceleration/energy drift too large 6.27090818302612
+ 17.8341402870532 split increased to 2 itime 623203
+ itsplit 1
+ acceleration/energy drift too large 3.30319687192904
+ 10.6416920545302 split increased to 2 itime 623301
+ itsplit 1
+ acceleration/energy drift too large 4.41300470265790
+ 11.7638616535732 split increased to 2 itime 627403
+ itsplit 1
+ acceleration/energy drift too large 3.09923768567914
+ 10.7253101609193 split increased to 2 itime 631853
+ itsplit 1
+ acceleration/energy drift too large 5.62796992462099
+ 10.3503562492554 split increased to 2 itime 632864
+ itsplit 1
+ acceleration/energy drift too large 2.96135814596404
+ 10.1756354165387 split increased to 2 itime 635363
+ itsplit 1
+ acceleration/energy drift too large 2.80933381483433
+ 10.3437431241457 split increased to 2 itime 635467
+ itsplit 1
+ acceleration/energy drift too large 3.23269975789914
+ 10.4154201891087 split increased to 2 itime 635502
+ itsplit 1
+ acceleration/energy drift too large 10.4255130609354
+ 47.4938112377871 split increased to 2 itime 638911
+ itsplit 1
+ acceleration/energy drift too large 5.87198866748517
+ 18.7968098752258 split increased to 2 itime 640260
+ itsplit 1
+ acceleration/energy drift too large 1.90355444256178
+ 10.0243694970490 split increased to 2 itime 643660
+ itsplit 1
+ acceleration/energy drift too large 6.00662908239308
+ 18.5934523705130 split increased to 2 itime 646880
+ itsplit 1
+ acceleration/energy drift too large 7.49660344390383
+ 20.5238748314072 split increased to 2 itime 647821
+ itsplit 1
+ acceleration/energy drift too large 2.73347226218210
+ 10.6018274332205 split increased to 2 itime 651091
+ itsplit 1
+ acceleration/energy drift too large 4.95846274240792
+ 17.4485778837620 split increased to 2 itime 651610
+ itsplit 1
+ acceleration/energy drift too large 4.45714053539027
+ 13.3830812958228 split increased to 2 itime 651859
+ itsplit 1
+ acceleration/energy drift too large 5.22466369019300
+ 13.5535213352147 split increased to 2 itime 651860
+ itsplit 1
+ acceleration/energy drift too large 3.83020050998954
+ 12.3136388280477 split increased to 2 itime 654074
+ itsplit 1
+ acceleration/energy drift too large 8.19583179155746
+ 26.5283706841122 split increased to 2 itime 656670
+ itsplit 1
+ acceleration/energy drift too large 5.52015940770695
+ 30.6647644951820 split increased to 2 itime 656826
+ itsplit 1
+ acceleration/energy drift too large 6.15072083966337
+ 16.7381585501766 split increased to 2 itime 657528
+ itsplit 1
+ acceleration/energy drift too large 3.35944508135426
+ 13.3468361226162 split increased to 2 itime 657566
+ itsplit 1
+ acceleration/energy drift too large 3.92379124958539
+ 23.8904289152300 split increased to 2 itime 660743
+ itsplit 1
+ acceleration/energy drift too large 6.27215536868314
+ 19.7485597493940 split increased to 2 itime 660953
+ itsplit 1
+ acceleration/energy drift too large 5.58874584037967
+ 21.3180473977209 split increased to 2 itime 662305
+ itsplit 1
+ acceleration/energy drift too large 2.47105745086375
+ 10.8315379730362 split increased to 2 itime 664015
+ itsplit 1
+ acceleration/energy drift too large 4.14784651207851
+ 12.6777020756079 split increased to 2 itime 664447
+ itsplit 1
+ acceleration/energy drift too large 6.61942475059945
+ 22.7582893899522 split increased to 2 itime 666018
+ itsplit 1
+ acceleration/energy drift too large 6.05590419311435
+ 16.7644675771342 split increased to 2 itime 666084
+ itsplit 1
+ acceleration/energy drift too large 4.71957983398420
+ 10.5101148846043 split increased to 2 itime 671495
+ itsplit 1
+ acceleration/energy drift too large 5.87757269010418
+ 14.7966932352975 split increased to 2 itime 676781
+ itsplit 1
+ acceleration/energy drift too large 4.70268396608510
+ 11.6312329467050 split increased to 2 itime 680262
+ itsplit 1
+ acceleration/energy drift too large 2.30741255261367
+ 12.7487854698828 split increased to 2 itime 683617
+ itsplit 1
+ acceleration/energy drift too large 2.67744296955034
+ 10.8174126600248 split increased to 2 itime 684868
+ itsplit 1
+ acceleration/energy drift too large 2.24912250262123
+ 10.0170929220302 split increased to 2 itime 684964
+ itsplit 1
+ acceleration/energy drift too large 4.56958484558269
+ 11.9543016156776 split increased to 2 itime 685024
+ itsplit 1
+ acceleration/energy drift too large 4.69120876127575
+ 13.2506867305285 split increased to 2 itime 685270
+ itsplit 1
+ acceleration/energy drift too large 4.24753499051130
+ 14.0617669655862 split increased to 2 itime 686190
+ itsplit 1
+ acceleration/energy drift too large 5.65742273820710
+ 15.3199501889026 split increased to 2 itime 691808
+ itsplit 1
+ acceleration/energy drift too large 2.71552843573751
+ 20.9363108725842 split increased to 2 itime 696360
+ itsplit 1
+ acceleration/energy drift too large 2.68882845348470
+ 10.8476205629594 split increased to 2 itime 696431
+ itsplit 1
+ acceleration/energy drift too large 2.55133505303908
+ 10.0691708036634 split increased to 2 itime 696453
+ itsplit 1
+ REMD synchro at 700000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 277.035156250000 0.000000000000000E+000
+ REMD writing rst time= 7.812500000000000E-003
+ REMD writing traj time= 0.000000000000000E+000
+ NREP 16
+ACC 1 250.00000 0.14286 7
+ACC 2 260.00000 0.85714 7
+ACC 3 270.00000 0.42857 7
+ACC 4 280.00000 0.42857 7
+ACC 5 290.00000 0.57143 7
+ACC 6 300.00000 1.00000 7
+ACC 7 310.00000 0.57143 7
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 7.812500000000000E-003
+ acceleration/energy drift too large 6.22266890588796
+ 12.6661075702502 split increased to 2 itime 700068
+ itsplit 1
+ acceleration/energy drift too large 9.51331039119436
+ 46.5884930839135 split increased to 2 itime 702152
+ itsplit 1
+ acceleration/energy drift too large 3.96521624926443
+ 13.5199319773856 split increased to 2 itime 703020
+ itsplit 1
+ acceleration/energy drift too large 2.31769733540108
+ 11.2623959237660 split increased to 2 itime 703713
+ itsplit 1
+ acceleration/energy drift too large 3.14013338796327
+ 10.1392006128887 split increased to 2 itime 704579
+ itsplit 1
+ acceleration/energy drift too large 4.30260026694695
+ 10.8277639501245 split increased to 2 itime 704633
+ itsplit 1
+ acceleration/energy drift too large 3.79340602147752
+ 10.2174202512299 split increased to 2 itime 704653
+ itsplit 1
+ acceleration/energy drift too large 3.90712629883964
+ 10.7558970446412 split increased to 2 itime 704697
+ itsplit 1
+ acceleration/energy drift too large 2.57072438235097
+ 10.1708785450332 split increased to 2 itime 704714
+ itsplit 1
+ acceleration/energy drift too large 2.32481535748189
+ 10.0992584273175 split increased to 2 itime 704731
+ itsplit 1
+ acceleration/energy drift too large 2.99259910061795
+ 11.9263837798394 split increased to 2 itime 704803
+ itsplit 1
+ acceleration/energy drift too large 2.82185404611476
+ 11.7890904603667 split increased to 2 itime 704809
+ itsplit 1
+ acceleration/energy drift too large 4.93060823139295
+ 11.3672797038217 split increased to 2 itime 704935
+ itsplit 1
+ acceleration/energy drift too large 6.29362157794411
+ 23.0408089547767 split increased to 2 itime 706379
+ itsplit 1
+ acceleration/energy drift too large 4.15499683296232
+ 14.4548981011180 split increased to 2 itime 709005
+ itsplit 1
+ acceleration/energy drift too large 5.85433210797833
+ 12.9809461776784 split increased to 2 itime 709899
+ itsplit 1
+ acceleration/energy drift too large 6.37249040788880
+ 10.1845088664188 split increased to 2 itime 711292
+ itsplit 1
+ acceleration/energy drift too large 2.43871175449653
+ 12.0194665995961 split increased to 2 itime 711336
+ itsplit 1
+ acceleration/energy drift too large 4.91036013100709
+ 14.2538814376394 split increased to 2 itime 712027
+ itsplit 1
+ acceleration/energy drift too large 7.11866966174388
+ 12.8125687896244 split increased to 2 itime 712028
+ itsplit 1
+ acceleration/energy drift too large 2.06789994113342
+ 10.7297438434284 split increased to 2 itime 712844
+ itsplit 1
+ acceleration/energy drift too large 5.91841175101234
+ 21.0639236808578 split increased to 2 itime 714602
+ itsplit 1
+ acceleration/energy drift too large 2.14729074036192
+ 11.6876187789188 split increased to 2 itime 715010
+ itsplit 1
+ acceleration/energy drift too large 1.37558015177382
+ 10.6762540083382 split increased to 2 itime 718072
+ itsplit 1
+ acceleration/energy drift too large 7.88001573400738
+ 16.7010510809287 split increased to 2 itime 719960
+ itsplit 1
+ acceleration/energy drift too large 5.50961900450896
+ 20.9418275826827 split increased to 2 itime 720707
+ itsplit 1
+ acceleration/energy drift too large 5.64194229379561
+ 17.5436546543736 split increased to 2 itime 720750
+ itsplit 1
+ acceleration/energy drift too large 3.79069110714974
+ 10.4397124133296 split increased to 2 itime 721129
+ itsplit 1
+ acceleration/energy drift too large 6.16434414605557
+ 17.2978104861773 split increased to 2 itime 723275
+ itsplit 1
+ acceleration/energy drift too large 2.18866433835450
+ 12.0872562691630 split increased to 2 itime 724159
+ itsplit 1
+ acceleration/energy drift too large 1.92793341597504
+ 11.6349468563801 split increased to 2 itime 724173
+ itsplit 1
+ acceleration/energy drift too large 10.3477291010657
+ 51.1382922793785 split increased to 2 itime 724413
+ itsplit 1
+ acceleration/energy drift too large 4.74872353084568
+ 14.3388923931449 split increased to 2 itime 724864
+ itsplit 1
+ acceleration/energy drift too large 4.54821629271186
+ 10.1563648822652 split increased to 2 itime 725474
+ itsplit 1
+ acceleration/energy drift too large 3.04487599446844
+ 10.5098884587661 split increased to 2 itime 725556
+ itsplit 1
+ acceleration/energy drift too large 1.74252407607005
+ 10.5560182171380 split increased to 2 itime 725562
+ itsplit 1
+ acceleration/energy drift too large 3.65588481295424
+ 11.3761342370342 split increased to 2 itime 725652
+ itsplit 1
+ acceleration/energy drift too large 12.9162686863904
+ 58.0407274520310 split increased to 2 itime 727423
+ itsplit 1
+ acceleration/energy drift too large 2.99709526832101
+ 11.9844223981653 split increased to 2 itime 728538
+ itsplit 1
+ acceleration/energy drift too large 3.25691131706594
+ 17.0932412937603 split increased to 2 itime 728928
+ itsplit 1
+ acceleration/energy drift too large 8.29471280000083
+ 28.4247317904830 split increased to 2 itime 729033
+ itsplit 1
+ acceleration/energy drift too large 4.46197633984267
+ 13.8385655572551 split increased to 2 itime 730125
+ itsplit 1
+ acceleration/energy drift too large 2.33043471461783
+ 11.5594750922131 split increased to 2 itime 730380
+ itsplit 1
+ acceleration/energy drift too large 3.33095258859194
+ 10.5290068329757 split increased to 2 itime 730465
+ itsplit 1
+ acceleration/energy drift too large 3.52812084852736
+ 10.5249371233442 split increased to 2 itime 733411
+ itsplit 1
+ acceleration/energy drift too large 3.09534534055926
+ 10.8869033703203 split increased to 2 itime 733490
+ itsplit 1
+ acceleration/energy drift too large 6.81656746870041
+ 18.5260397263884 split increased to 2 itime 736492
+ itsplit 1
+ acceleration/energy drift too large 2.37441913926064
+ 10.0831657586972 split increased to 2 itime 737486
+ itsplit 1
+ acceleration/energy drift too large 3.28860019907596
+ 13.6743085791983 split increased to 2 itime 737490
+ itsplit 1
+ acceleration/energy drift too large 6.06172075079157
+ 11.3267029982673 split increased to 2 itime 737492
+ itsplit 1
+ acceleration/energy drift too large 2.77463062763506
+ 15.5797344382572 split increased to 2 itime 737493
+ itsplit 1
+ acceleration/energy drift too large 3.22343911246678
+ 17.6986544451253 split increased to 2 itime 739320
+ itsplit 1
+ acceleration/energy drift too large 4.89875257823104
+ 11.4649270392609 split increased to 2 itime 742455
+ itsplit 1
+ acceleration/energy drift too large 4.75158497962348
+ 12.6082178953383 split increased to 2 itime 744572
+ itsplit 1
+ acceleration/energy drift too large 2.74496998422814
+ 10.3546918786311 split increased to 2 itime 746090
+ itsplit 1
+ acceleration/energy drift too large 5.62501434075069
+ 23.7461701691730 split increased to 2 itime 747582
+ itsplit 1
+ acceleration/energy drift too large 7.96162609855469
+ 30.2392839742710 split increased to 2 itime 749090
+ itsplit 1
+ acceleration/energy drift too large 3.42663958022221
+ 10.3137392120728 split increased to 2 itime 750002
+ itsplit 1
+ acceleration/energy drift too large 3.94798962433313
+ 13.5840312731322 split increased to 2 itime 750700
+ itsplit 1
+ acceleration/energy drift too large 5.55416200822033
+ 11.5922393481714 split increased to 2 itime 750793
+ itsplit 1
+ acceleration/energy drift too large 7.37737629259915
+ 33.2192898999782 split increased to 2 itime 751143
+ itsplit 1
+ acceleration/energy drift too large 9.74765156075217
+ 40.5652048236205 split increased to 2 itime 752334
+ itsplit 1
+ acceleration/energy drift too large 2.75185830786940
+ 14.2839987470299 split increased to 4 itime 752334
+ itsplit 2
+ acceleration/energy drift too large 8.01415033522304
+ 37.9807863381783 split increased to 2 itime 752598
+ itsplit 1
+ acceleration/energy drift too large 3.39019241179640
+ 11.8851666061507 split increased to 2 itime 752654
+ itsplit 1
+ acceleration/energy drift too large 2.71927022721466
+ 10.7506677715094 split increased to 2 itime 752662
+ itsplit 1
+ acceleration/energy drift too large 3.16063497524178
+ 11.5982865238897 split increased to 2 itime 752666
+ itsplit 1
+ acceleration/energy drift too large 3.63328760304736
+ 10.7779957825044 split increased to 2 itime 752668
+ itsplit 1
+ acceleration/energy drift too large 4.54701927735100
+ 14.9645381490278 split increased to 2 itime 752670
+ itsplit 1
+ acceleration/energy drift too large 2.70267763244291
+ 17.9240564782548 split increased to 2 itime 752671
+ itsplit 1
+ acceleration/energy drift too large 3.93012845718014
+ 17.3955629802141 split increased to 2 itime 752674
+ itsplit 1
+ acceleration/energy drift too large 2.53007938244950
+ 12.4786302939834 split increased to 2 itime 752675
+ itsplit 1
+ acceleration/energy drift too large 1.93592683164267
+ 11.3481660210413 split increased to 2 itime 752676
+ itsplit 1
+ acceleration/energy drift too large 2.70582264035735
+ 14.2620859802954 split increased to 2 itime 752677
+ itsplit 1
+ acceleration/energy drift too large 4.69534375261343
+ 10.0307207112296 split increased to 2 itime 752680
+ itsplit 1
+ acceleration/energy drift too large 3.92375264456935
+ 24.4564216859469 split increased to 2 itime 752681
+ itsplit 1
+ acceleration/energy drift too large 4.13597688821239
+ 12.1091242600619 split increased to 2 itime 752683
+ itsplit 1
+ acceleration/energy drift too large 3.30349623467196
+ 10.6975070038883 split increased to 2 itime 752699
+ itsplit 1
+ acceleration/energy drift too large 2.32553240270026
+ 10.6096164382573 split increased to 2 itime 752710
+ itsplit 1
+ acceleration/energy drift too large 6.43861795995971
+ 23.9445264510033 split increased to 2 itime 754176
+ itsplit 1
+ acceleration/energy drift too large 6.65909780895276
+ 24.7712700580553 split increased to 2 itime 755802
+ itsplit 1
+ acceleration/energy drift too large 6.31224328170568
+ 27.8753701959217 split increased to 2 itime 757544
+ itsplit 1
+ acceleration/energy drift too large 4.48723279416695
+ 11.1611142785821 split increased to 2 itime 760174
+ itsplit 1
+ acceleration/energy drift too large 6.34321528508540
+ 28.3845570208157 split increased to 2 itime 761469
+ itsplit 1
+ acceleration/energy drift too large 4.98912518953887
+ 15.9434464120301 split increased to 2 itime 761679
+ itsplit 1
+ acceleration/energy drift too large 2.22826320663272
+ 10.4591009882225 split increased to 2 itime 763514
+ itsplit 1
+ acceleration/energy drift too large 2.02339216982524
+ 11.3051217232850 split increased to 2 itime 764060
+ itsplit 1
+ acceleration/energy drift too large 3.28425106141271
+ 11.0262454110569 split increased to 2 itime 764585
+ itsplit 1
+ acceleration/energy drift too large 4.42973235374506
+ 12.6205906290086 split increased to 2 itime 765017
+ itsplit 1
+ acceleration/energy drift too large 2.94120892814721
+ 10.2999938728404 split increased to 2 itime 765207
+ itsplit 1
+ acceleration/energy drift too large 3.15715782038621
+ 11.6713629185368 split increased to 2 itime 765427
+ itsplit 1
+ acceleration/energy drift too large 3.83985778573164
+ 10.7037262604643 split increased to 2 itime 765446
+ itsplit 1
+ acceleration/energy drift too large 2.53572800981734
+ 10.3157938996068 split increased to 2 itime 765482
+ itsplit 1
+ acceleration/energy drift too large 2.21298244307038
+ 11.1093082892149 split increased to 2 itime 769580
+ itsplit 1
+ acceleration/energy drift too large 3.29300495707773
+ 13.2049661076360 split increased to 2 itime 771041
+ itsplit 1
+ acceleration/energy drift too large 5.45466165996365
+ 11.9730532482924 split increased to 2 itime 771074
+ itsplit 1
+ acceleration/energy drift too large 2.22016181059518
+ 12.1897517361002 split increased to 2 itime 771728
+ itsplit 1
+ acceleration/energy drift too large 4.61595200678173
+ 12.0665208836666 split increased to 2 itime 774652
+ itsplit 1
+ acceleration/energy drift too large 12.5062223036267
+ 59.7358890940530 split increased to 2 itime 775245
+ itsplit 1
+ acceleration/energy drift too large 5.82877859574045
+ 20.4872113237601 split increased to 2 itime 776623
+ itsplit 1
+ acceleration/energy drift too large 4.75061268948376
+ 19.4190154892775 split increased to 2 itime 776802
+ itsplit 1
+ acceleration/energy drift too large 3.76318014509958
+ 13.4573827772317 split increased to 2 itime 777059
+ itsplit 1
+ acceleration/energy drift too large 3.61202757868461
+ 11.5809109827906 split increased to 2 itime 777705
+ itsplit 1
+ acceleration/energy drift too large 4.59013567773438
+ 19.7737190746432 split increased to 2 itime 779006
+ itsplit 1
+ acceleration/energy drift too large 2.47941140224892
+ 12.5596786766523 split increased to 2 itime 779100
+ itsplit 1
+ acceleration/energy drift too large 4.40850530238053
+ 13.3042199927031 split increased to 2 itime 779155
+ itsplit 1
+ acceleration/energy drift too large 6.52049828678658
+ 30.5147611262913 split increased to 2 itime 779583
+ itsplit 1
+ acceleration/energy drift too large 3.96614136123242
+ 16.3052873194727 split increased to 2 itime 779694
+ itsplit 1
+ acceleration/energy drift too large 2.80761466352017
+ 10.8020220812645 split increased to 2 itime 780430
+ itsplit 1
+ acceleration/energy drift too large 2.69150725633322
+ 11.4320329612564 split increased to 2 itime 780506
+ itsplit 1
+ acceleration/energy drift too large 2.31246469838370
+ 10.1715031267633 split increased to 2 itime 780534
+ itsplit 1
+ acceleration/energy drift too large 2.91305584981933
+ 16.0521974514247 split increased to 2 itime 781433
+ itsplit 1
+ acceleration/energy drift too large 4.20825139806427
+ 10.2831988021314 split increased to 2 itime 785918
+ itsplit 1
+ acceleration/energy drift too large 9.28235213637268
+ 31.8161089853804 split increased to 2 itime 786211
+ itsplit 1
+ acceleration/energy drift too large 6.56612847390236
+ 22.1401796718833 split increased to 2 itime 787172
+ itsplit 1
+ acceleration/energy drift too large 4.79753464246649
+ 14.7871961257921 split increased to 2 itime 787230
+ itsplit 1
+ acceleration/energy drift too large 4.53001944401006
+ 13.4596297260193 split increased to 2 itime 787404
+ itsplit 1
+ acceleration/energy drift too large 3.52590185762793
+ 11.0933145233756 split increased to 2 itime 788773
+ itsplit 1
+ acceleration/energy drift too large 3.24628595522011
+ 10.1379721933316 split increased to 2 itime 788789
+ itsplit 1
+ acceleration/energy drift too large 8.13555058663948
+ 27.3970801761403 split increased to 2 itime 789193
+ itsplit 1
+ acceleration/energy drift too large 4.97947890777512
+ 11.8074350454522 split increased to 2 itime 789718
+ itsplit 1
+ acceleration/energy drift too large 3.14323754984929
+ 22.3580002588657 split increased to 2 itime 790645
+ itsplit 1
+ acceleration/energy drift too large 2.93611998222082
+ 12.5302668042684 split increased to 2 itime 790754
+ itsplit 1
+ acceleration/energy drift too large 4.83192823545234
+ 10.1348264580107 split increased to 2 itime 791148
+ itsplit 1
+ acceleration/energy drift too large 4.56230792637775
+ 12.8050537538552 split increased to 2 itime 791350
+ itsplit 1
+ acceleration/energy drift too large 2.65443967226289
+ 10.9506323764367 split increased to 2 itime 792428
+ itsplit 1
+ acceleration/energy drift too large 1.98530114114582
+ 10.2207210542826 split increased to 2 itime 792844
+ itsplit 1
+ acceleration/energy drift too large 3.72021028707633
+ 17.8879040240107 split increased to 2 itime 793143
+ itsplit 1
+ acceleration/energy drift too large 3.61728738110863
+ 11.1272742839188 split increased to 2 itime 797798
+ itsplit 1
+ REMD synchro at 800000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 316.710937500000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 3.906250000000000E-003
+ NREP 16
+ACC 1 250.00000 0.12500 8
+ACC 2 260.00000 0.87500 8
+ACC 3 270.00000 0.37500 8
+ACC 4 280.00000 0.37500 8
+ACC 5 290.00000 0.50000 8
+ACC 6 300.00000 1.00000 8
+ACC 7 310.00000 0.50000 8
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 3.906250000000000E-003
+ acceleration/energy drift too large 3.04759777189784
+ 18.7060242851618 split increased to 2 itime 801728
+ itsplit 1
+ acceleration/energy drift too large 2.22856245957937
+ 10.4667759896492 split increased to 2 itime 804170
+ itsplit 1
+ acceleration/energy drift too large 6.77200349485410
+ 15.6108881982449 split increased to 2 itime 805253
+ itsplit 1
+ acceleration/energy drift too large 2.92268838706356
+ 11.3913275960643 split increased to 2 itime 805981
+ itsplit 1
+ acceleration/energy drift too large 2.20186141875850
+ 16.5969788373684 split increased to 2 itime 805991
+ itsplit 1
+ acceleration/energy drift too large 3.26888472192852
+ 10.4691788354374 split increased to 2 itime 806013
+ itsplit 1
+ acceleration/energy drift too large 7.35738879298710
+ 12.3324564942039 split increased to 2 itime 806539
+ itsplit 1
+ acceleration/energy drift too large 5.99982704607795
+ 13.3850910299251 split increased to 2 itime 807225
+ itsplit 1
+ acceleration/energy drift too large 5.65676101821954
+ 13.3763648943318 split increased to 2 itime 807891
+ itsplit 1
+ acceleration/energy drift too large 4.34452019221622
+ 16.1765012039935 split increased to 2 itime 808051
+ itsplit 1
+ acceleration/energy drift too large 6.51759969102698
+ 22.1321750993877 split increased to 2 itime 809171
+ itsplit 1
+ acceleration/energy drift too large 7.41463375510252
+ 17.3870892440910 split increased to 2 itime 810298
+ itsplit 1
+ acceleration/energy drift too large 7.11636198571468
+ 15.7083718145018 split increased to 2 itime 812174
+ itsplit 1
+ acceleration/energy drift too large 6.99345218756695
+ 12.6066793494944 split increased to 2 itime 813088
+ itsplit 1
+ acceleration/energy drift too large 4.88914563824126
+ 10.0797024024354 split increased to 2 itime 813090
+ itsplit 1
+ acceleration/energy drift too large 5.78989847351531
+ 17.5514012724352 split increased to 2 itime 813188
+ itsplit 1
+ acceleration/energy drift too large 6.52304330575791
+ 20.8891504105015 split increased to 2 itime 814975
+ itsplit 1
+ acceleration/energy drift too large 6.78932255060707
+ 22.6187214644894 split increased to 2 itime 815828
+ itsplit 1
+ acceleration/energy drift too large 5.70187046947739
+ 25.3896359485052 split increased to 2 itime 819835
+ itsplit 1
+ acceleration/energy drift too large 7.60129848518354
+ 14.4662270115419 split increased to 2 itime 820407
+ itsplit 1
+ acceleration/energy drift too large 8.94712944173327
+ 40.5229942903566 split increased to 2 itime 820997
+ itsplit 1
+ acceleration/energy drift too large 2.27515445880527
+ 11.5921771460632 split increased to 2 itime 821442
+ itsplit 1
+ acceleration/energy drift too large 6.10202055689394
+ 16.2729463075284 split increased to 2 itime 822156
+ itsplit 1
+ acceleration/energy drift too large 6.05080806452347
+ 14.7580457859862 split increased to 2 itime 822976
+ itsplit 1
+ acceleration/energy drift too large 2.85519928755847
+ 17.6127447620196 split increased to 2 itime 823202
+ itsplit 1
+ acceleration/energy drift too large 2.42083645981002
+ 10.1414285292442 split increased to 2 itime 823701
+ itsplit 1
+ acceleration/energy drift too large 3.37307205526463
+ 10.0273966515836 split increased to 2 itime 826914
+ itsplit 1
+ acceleration/energy drift too large 6.70091105106446
+ 30.9687909321332 split increased to 2 itime 829363
+ itsplit 1
+ acceleration/energy drift too large 7.49652171519678
+ 27.3864183397681 split increased to 2 itime 829712
+ itsplit 1
+ acceleration/energy drift too large 6.44468908840959
+ 12.2284361325357 split increased to 2 itime 833320
+ itsplit 1
+ acceleration/energy drift too large 2.20579661362847
+ 10.2083614511523 split increased to 2 itime 835148
+ itsplit 1
+ acceleration/energy drift too large 5.67624996204251
+ 13.1411314216703 split increased to 2 itime 837025
+ itsplit 1
+ acceleration/energy drift too large 6.13511514714189
+ 16.2900273754332 split increased to 2 itime 837859
+ itsplit 1
+ acceleration/energy drift too large 3.45128896192725
+ 10.5339807991883 split increased to 2 itime 841002
+ itsplit 1
+ acceleration/energy drift too large 3.78413427004312
+ 10.4759495757062 split increased to 2 itime 841682
+ itsplit 1
+ acceleration/energy drift too large 10.4467310552014
+ 24.0624742452977 split increased to 2 itime 841928
+ itsplit 1
+ acceleration/energy drift too large 10.6572572005651
+ 48.7266139510165 split increased to 2 itime 843813
+ itsplit 1
+ acceleration/energy drift too large 10.5187685685253
+ 57.4974130270608 split increased to 2 itime 845094
+ itsplit 1
+ acceleration/energy drift too large 3.77028861361857
+ 11.6618188904552 split increased to 2 itime 845735
+ itsplit 1
+ acceleration/energy drift too large 3.93731307191247
+ 10.3570731231119 split increased to 2 itime 845742
+ itsplit 1
+ acceleration/energy drift too large 6.77690029195726
+ 16.4544130420051 split increased to 2 itime 846072
+ itsplit 1
+ acceleration/energy drift too large 5.37345742277203
+ 10.9478987632294 split increased to 2 itime 851275
+ itsplit 1
+ acceleration/energy drift too large 4.16182393568173
+ 10.9511961733471 split increased to 2 itime 853954
+ itsplit 1
+ acceleration/energy drift too large 8.78794325347103
+ 42.5222746105986 split increased to 2 itime 854063
+ itsplit 1
+ acceleration/energy drift too large 6.06118199381852
+ 17.1308611655635 split increased to 2 itime 854352
+ itsplit 1
+ acceleration/energy drift too large 5.65592795192431
+ 14.8508816410991 split increased to 2 itime 855139
+ itsplit 1
+ acceleration/energy drift too large 4.31732146161154
+ 12.0237786935408 split increased to 2 itime 855897
+ itsplit 1
+ acceleration/energy drift too large 2.11890083164189
+ 13.6398371612654 split increased to 2 itime 857176
+ itsplit 1
+ acceleration/energy drift too large 5.27429184727652
+ 10.5851496939040 split increased to 2 itime 858662
+ itsplit 1
+ acceleration/energy drift too large 5.61930943363464
+ 20.1521530640847 split increased to 2 itime 859365
+ itsplit 1
+ acceleration/energy drift too large 3.08288564641486
+ 12.1358042117614 split increased to 2 itime 861081
+ itsplit 1
+ acceleration/energy drift too large 6.91619947579062
+ 49.3098548076224 split increased to 2 itime 861264
+ itsplit 1
+ acceleration/energy drift too large 5.38727465260426
+ 13.2374522040566 split increased to 2 itime 863426
+ itsplit 1
+ acceleration/energy drift too large 5.39003544515304
+ 33.0444794455022 split increased to 2 itime 864140
+ itsplit 1
+ acceleration/energy drift too large 4.93064701647301
+ 14.2349057947620 split increased to 2 itime 864734
+ itsplit 1
+ acceleration/energy drift too large 6.30306667302373
+ 19.4690950459115 split increased to 2 itime 868328
+ itsplit 1
+ acceleration/energy drift too large 3.17746244824330
+ 10.5385535492896 split increased to 2 itime 868785
+ itsplit 1
+ acceleration/energy drift too large 2.88701041329839
+ 10.0650233930427 split increased to 2 itime 868816
+ itsplit 1
+ acceleration/energy drift too large 2.88597847216602
+ 10.4353554435539 split increased to 2 itime 868878
+ itsplit 1
+ acceleration/energy drift too large 2.66208260031996
+ 10.3756083999508 split increased to 2 itime 868992
+ itsplit 1
+ acceleration/energy drift too large 3.84052652351550
+ 11.5376282082245 split increased to 2 itime 869006
+ itsplit 1
+ acceleration/energy drift too large 5.24811610152903
+ 16.0725220913960 split increased to 2 itime 872858
+ itsplit 1
+ acceleration/energy drift too large 2.04415916115678
+ 11.6000945265094 split increased to 2 itime 876626
+ itsplit 1
+ acceleration/energy drift too large 4.91667573608756
+ 12.2529460280596 split increased to 2 itime 876696
+ itsplit 1
+ acceleration/energy drift too large 1.98464299693557
+ 12.3672973239493 split increased to 2 itime 880220
+ itsplit 1
+ acceleration/energy drift too large 4.49269347994387
+ 10.9164515956942 split increased to 2 itime 882114
+ itsplit 1
+ acceleration/energy drift too large 3.50691198966475
+ 12.2192361034298 split increased to 2 itime 882641
+ itsplit 1
+ acceleration/energy drift too large 4.67092628161820
+ 31.4015659810878 split increased to 2 itime 882749
+ itsplit 1
+ acceleration/energy drift too large 3.60048047862597
+ 14.2560887791626 split increased to 2 itime 883142
+ itsplit 1
+ acceleration/energy drift too large 5.02588008943109
+ 13.8107970171059 split increased to 2 itime 883587
+ itsplit 1
+ acceleration/energy drift too large 4.59667298918522
+ 10.3093389718401 split increased to 2 itime 884011
+ itsplit 1
+ acceleration/energy drift too large 5.08063823468998
+ 16.4090970757056 split increased to 2 itime 884446
+ itsplit 1
+ acceleration/energy drift too large 4.41398440161052
+ 12.8057265597627 split increased to 2 itime 887915
+ itsplit 1
+ acceleration/energy drift too large 6.51304699074663
+ 30.8992725213926 split increased to 2 itime 888333
+ itsplit 1
+ acceleration/energy drift too large 2.32735689444735
+ 12.6728165379389 split increased to 2 itime 890090
+ itsplit 1
+ acceleration/energy drift too large 5.74306766095227
+ 21.6139261527122 split increased to 2 itime 893159
+ itsplit 1
+ acceleration/energy drift too large 4.31719594275417
+ 15.1223402059815 split increased to 2 itime 893596
+ itsplit 1
+ acceleration/energy drift too large 7.13433176598262
+ 16.3572986251761 split increased to 2 itime 893901
+ itsplit 1
+ acceleration/energy drift too large 2.39688308186256
+ 13.2961484492678 split increased to 2 itime 895579
+ itsplit 1
+ acceleration/energy drift too large 3.99835623740062
+ 11.7749312853083 split increased to 2 itime 895583
+ itsplit 1
+ acceleration/energy drift too large 3.04375529760310
+ 10.3665733729487 split increased to 2 itime 895624
+ itsplit 1
+ acceleration/energy drift too large 2.11992299941375
+ 10.6935992947726 split increased to 2 itime 895872
+ itsplit 1
+ acceleration/energy drift too large 3.81521778771810
+ 22.9153789837453 split increased to 2 itime 897065
+ itsplit 1
+ REMD synchro at 900000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ REMD gather times= 356.390625000000 0.000000000000000E+000
+ REMD writing rst time= 0.000000000000000E+000
+ REMD writing traj time= 0.000000000000000E+000
+ NREP 16
+ACC 1 250.00000 0.22222 9
+ACC 2 260.00000 0.77778 9
+ACC 3 270.00000 0.44444 9
+ACC 4 280.00000 0.33333 9
+ACC 5 290.00000 0.55556 9
+ACC 6 300.00000 0.88889 9
+ACC 7 310.00000 0.55556 9
+ REMD scatter time= 0.000000000000000E+000
+ REMD exchange time= 0.000000000000000E+000
+ acceleration/energy drift too large 6.57808466903543
+ 14.2966236603601 split increased to 2 itime 900512
+ itsplit 1
+ acceleration/energy drift too large 2.59229150258786
+ 10.4080798753601 split increased to 2 itime 901350
+ itsplit 1
+ acceleration/energy drift too large 7.69125874110519
+ 23.7007796428610 split increased to 2 itime 902572
+ itsplit 1
+ acceleration/energy drift too large 3.21110129327291
+ 10.0423126070215 split increased to 2 itime 903784
+ itsplit 1
+ acceleration/energy drift too large 12.3085257846634
+ 55.2456446465172 split increased to 2 itime 905864
+ itsplit 1
+ acceleration/energy drift too large 4.52591552115366
+ 14.1527736760797 split increased to 2 itime 907361
+ itsplit 1
+ acceleration/energy drift too large 1.99420534523600
+ 11.8715454235411 split increased to 2 itime 908938
+ itsplit 1
+ acceleration/energy drift too large 2.84991716936482
+ 11.5679143197226 split increased to 2 itime 909045
+ itsplit 1
+ acceleration/energy drift too large 2.53446373565771
+ 11.3900046128801 split increased to 2 itime 909053
+ itsplit 1
+ acceleration/energy drift too large 5.62223323930956
+ 17.2458777836118 split increased to 2 itime 910736
+ itsplit 1
+ acceleration/energy drift too large 2.50303839568308
+ 10.0124697161464 split increased to 2 itime 913252
+ itsplit 1
+ acceleration/energy drift too large 9.53925841058432
+ 23.8317261527347 split increased to 2 itime 914590
+ itsplit 1
+ acceleration/energy drift too large 7.33635983353724
+ 19.8127222755395 split increased to 2 itime 915005
+ itsplit 1
+ acceleration/energy drift too large 3.48151431215448
+ 11.2218821811313 split increased to 2 itime 915007
+ itsplit 1
+ acceleration/energy drift too large 4.10632542294466
+ 13.0497696370744 split increased to 2 itime 915022
+ itsplit 1
+ acceleration/energy drift too large 9.78569117524985
+ 51.4740864589150 split increased to 2 itime 915241
+ itsplit 1
+ acceleration/energy drift too large 6.82349686974094
+ 11.6662522868597 split increased to 2 itime 916490
+ itsplit 1
+ acceleration/energy drift too large 2.74022016143286
+ 10.1010455244959 split increased to 2 itime 917947
+ itsplit 1
+ acceleration/energy drift too large 2.94194580192428
+ 10.5895677935487 split increased to 2 itime 917971
+ itsplit 1
+ acceleration/energy drift too large 2.82987203862736
+ 11.7440458452996 split increased to 2 itime 918684
+ itsplit 1
+ acceleration/energy drift too large 3.00173322785880
+ 25.0402825339256 split increased to 2 itime 919194
+ itsplit 1
+ acceleration/energy drift too large 2.99244821271598
+ 11.0034601559579 split increased to 2 itime 919201
+ itsplit 1
+ acceleration/energy drift too large 6.02766240115596
+ 14.8292955735467 split increased to 2 itime 919207
+ itsplit 1
+ acceleration/energy drift too large 3.63575502704983
+ 11.6958101490394 split increased to 2 itime 919269
+ itsplit 1
+ acceleration/energy drift too large 9.55824968091900
+ 45.0413460650973 split increased to 2 itime 922102
+ itsplit 1
+ acceleration/energy drift too large 5.50561610467060
+ 12.6180871997014 split increased to 2 itime 923657
+ itsplit 1
+ acceleration/energy drift too large 3.67059804217777
+ 10.6979141333425 split increased to 2 itime 926714
+ itsplit 1
+ acceleration/energy drift too large 2.87037855157929
+ 11.0114182279410 split increased to 2 itime 926960
+ itsplit 1
+ acceleration/energy drift too large 3.83599108776069
+ 10.6136638404860 split increased to 2 itime 926966
+ itsplit 1
+ acceleration/energy drift too large 3.87514699109772
+ 11.0254533115330 split increased to 2 itime 926970
+ itsplit 1
+ acceleration/energy drift too large 3.06859856212539
+ 12.6944728423738 split increased to 2 itime 926972
+ itsplit 1
+ acceleration/energy drift too large 3.46351253852467
+ 10.2494671797253 split increased to 2 itime 926973
+ itsplit 1
+ acceleration/energy drift too large 3.41444583137636
+ 10.5729581975494 split increased to 2 itime 926976
+ itsplit 1
+ acceleration/energy drift too large 5.21210460392176
+ 13.1796326048392 split increased to 2 itime 926978
+ itsplit 1
+ acceleration/energy drift too large 3.65983122892536
+ 26.9572238171532 split increased to 2 itime 926979
+ itsplit 1
+ acceleration/energy drift too large 2.47157881740424
+ 10.2678318520229 split increased to 2 itime 926981
+ itsplit 1
+ acceleration/energy drift too large 2.85645612421451
+ 10.9145414840742 split increased to 2 itime 926990
+ itsplit 1
+ acceleration/energy drift too large 3.15608449228603
+ 13.0220703611050 split increased to 2 itime 926996
+ itsplit 1
+ acceleration/energy drift too large 3.82571307812826
+ 10.8922793852159 split increased to 2 itime 927000
+ itsplit 1
+ acceleration/energy drift too large 2.27942364753828
+ 13.7694575846206 split increased to 2 itime 927008
+ itsplit 1
+ acceleration/energy drift too large 3.09016258161837
+ 16.5599521943510 split increased to 2 itime 927009
+ itsplit 1
+ acceleration/energy drift too large 3.18421294728376
+ 10.0454781191284 split increased to 2 itime 927015
+ itsplit 1
+ acceleration/energy drift too large 2.70969727357187
+ 15.5925461600440 split increased to 2 itime 927018
+ itsplit 1
+ acceleration/energy drift too large 2.88282001617242
+ 14.1283319381754 split increased to 2 itime 927019
+ itsplit 1
+ acceleration/energy drift too large 3.45495914637524
+ 10.2673275171171 split increased to 2 itime 927034
+ itsplit 1
+ acceleration/energy drift too large 2.50607075740897
+ 10.9243714819508 split increased to 2 itime 927083
+ itsplit 1
+ acceleration/energy drift too large 3.75318427236537
+ 10.2977764810336 split increased to 2 itime 927178
+ itsplit 1
+ acceleration/energy drift too large 2.71375807232855
+ 17.9366836908205 split increased to 2 itime 927179
+ itsplit 1
+ acceleration/energy drift too large 3.69770394815231
+ 12.1854056584926 split increased to 2 itime 927196
+ itsplit 1
+ acceleration/energy drift too large 1.99682977481860
+ 14.1522017669013 split increased to 2 itime 927202
+ itsplit 1
+ acceleration/energy drift too large 5.54698662007708
+ 10.3967947650435 split increased to 2 itime 927206
+ itsplit 1
+ acceleration/energy drift too large 2.70288862979091
+ 12.3910446374871 split increased to 2 itime 927207
+ itsplit 1
+ acceleration/energy drift too large 3.37223749022815
+ 12.5286667840265 split increased to 2 itime 927214
+ itsplit 1
+ acceleration/energy drift too large 3.55972287078091
+ 12.2018193165741 split increased to 2 itime 927235
+ itsplit 1
+ acceleration/energy drift too large 2.76073460283047
+ 10.1915918099292 split increased to 2 itime 927284
+ itsplit 1
+ acceleration/energy drift too large 4.05274610413843
+ 10.0991188694881 split increased to 2 itime 933738
+ itsplit 1
+ acceleration/energy drift too large 5.23977091259578
+ 12.4834656884951 split increased to 2 itime 933995
+ itsplit 1
+ acceleration/energy drift too large 3.25498406440961
+ 10.3007320458467 split increased to 2 itime 938250
+ itsplit 1
+ acceleration/energy drift too large 2.94304604625915
+ 12.2444726278912 split increased to 2 itime 938253
+ itsplit 1
+ acceleration/energy drift too large 2.05798405881767
+ 11.5002360879095 split increased to 2 itime 938328
+ itsplit 1
+ acceleration/energy drift too large 3.44964489780285
+ 24.1476988477790 split increased to 2 itime 939850
+ itsplit 1
+ acceleration/energy drift too large 6.78885229817901
+ 16.5900023799422 split increased to 2 itime 943471
+ itsplit 1
+ acceleration/energy drift too large 5.82678507210135
+ 24.6340779037091 split increased to 2 itime 944680
+ itsplit 1
+ acceleration/energy drift too large 5.18940440922303
+ 12.7007904037800 split increased to 2 itime 945498
+ itsplit 1
+ acceleration/energy drift too large 5.35428437652620
+ 11.7535133734239 split increased to 2 itime 950427
+ itsplit 1
+ acceleration/energy drift too large 4.55162592862716
+ 10.8719958973851 split increased to 2 itime 951077
+ itsplit 1
+ acceleration/energy drift too large 6.38147579821281
+ 25.5401187665015 split increased to 2 itime 951175
+ itsplit 1
+ acceleration/energy drift too large 4.26729194647760
+ 10.1537846942208 split increased to 2 itime 951259
+ itsplit 1
+ acceleration/energy drift too large 4.76878350078769
+ 11.6116472107122 split increased to 2 itime 951754
+ itsplit 1
+ acceleration/energy drift too large 8.77958285185338
+ 30.4534713706681 split increased to 2 itime 952778
+ itsplit 1
+ acceleration/energy drift too large 3.56125187587214
+ 10.3168465365286 split increased to 2 itime 953676
+ itsplit 1
+ acceleration/energy drift too large 3.81612277478126
+ 10.1488231153088 split increased to 2 itime 953683
+ itsplit 1
+ acceleration/energy drift too large 3.33931536850662
+ 10.5224166868613 split increased to 2 itime 954051
+ itsplit 1
+ acceleration/energy drift too large 5.39546570956672
+ 10.2259661090390 split increased to 2 itime 954168
+ itsplit 1
+ acceleration/energy drift too large 5.01868309144268
+ 12.2560169529860 split increased to 2 itime 954247
+ itsplit 1
+ acceleration/energy drift too large 2.88496402964613
+ 10.3921477842572 split increased to 2 itime 954789
+ itsplit 1
+ acceleration/energy drift too large 2.54908704555533
+ 10.5976018513555 split increased to 2 itime 954818
+ itsplit 1
+ acceleration/energy drift too large 2.98289557057861
+ 10.6346457535264 split increased to 2 itime 954825
+ itsplit 1
+ acceleration/energy drift too large 3.31385324987540
+ 10.6927502609962 split increased to 2 itime 956021
+ itsplit 1
+ acceleration/energy drift too large 5.82454924506218
+ 10.3506060040066 split increased to 2 itime 958958
+ itsplit 1
+ acceleration/energy drift too large 7.90187303128310
+ 24.0423129854359 split increased to 2 itime 959066
+ itsplit 1
+ acceleration/energy drift too large 4.84078628479393
+ 10.8721029701479 split increased to 2 itime 959950
+ itsplit 1
+ acceleration/energy drift too large 5.38140146381624
+ 12.0821188629450 split increased to 2 itime 960750
+ itsplit 1
+ acceleration/energy drift too large 2.45200560225983
+ 12.2138919788738 split increased to 2 itime 963598
+ itsplit 1
+ acceleration/energy drift too large 4.80829251553583
+ 18.0786950351927 split increased to 2 itime 964756
+ itsplit 1
+ acceleration/energy drift too large 1.92684696104599
+ 14.3225498468162 split increased to 2 itime 965005
+ itsplit 1
+ acceleration/energy drift too large 3.38051856673097
+ 13.5164443579456 split increased to 2 itime 966501
+ itsplit 1
+ acceleration/energy drift too large 5.02392232851096
+ 18.2014384280205 split increased to 2 itime 968651
+ itsplit 1
+ acceleration/energy drift too large 10.8939133147482
+ 37.9792756831615 split increased to 2 itime 969921
+ itsplit 1
+ acceleration/energy drift too large 6.25537857545006
+ 15.7930940357674 split increased to 2 itime 973435
+ itsplit 1
+ acceleration/energy drift too large 4.95303977839136
+ 10.3895854620251 split increased to 2 itime 975524
+ itsplit 1
+ acceleration/energy drift too large 4.43505836691903
+ 12.4499447625922 split increased to 2 itime 976936
+ itsplit 1
+ acceleration/energy drift too large 2.22395266345729
+ 10.3183961405875 split increased to 2 itime 977785
+ itsplit 1
+ acceleration/energy drift too large 7.38517455742916
+ 13.7375899126670 split increased to 2 itime 979097
+ itsplit 1
+ acceleration/energy drift too large 5.42766800882002
+ 11.3746794397026 split increased to 2 itime 979138
+ itsplit 1
+ acceleration/energy drift too large 4.69477900799110
+ 13.9855929730825 split increased to 2 itime 980937
+ itsplit 1
+ acceleration/energy drift too large 4.56709827410279
+ 12.2866018672929 split increased to 2 itime 981082
+ itsplit 1
+ acceleration/energy drift too large 4.22843662737844
+ 15.9986236576054 split increased to 2 itime 983446
+ itsplit 1
+ acceleration/energy drift too large 7.28503729750069
+ 28.0900437565608 split increased to 2 itime 988502
+ itsplit 1
+ acceleration/energy drift too large 3.09892815129042
+ 13.1677379200501 split increased to 2 itime 989161
+ itsplit 1
+ acceleration/energy drift too large 5.02723350945619
+ 14.2627980639176 split increased to 2 itime 990132
+ itsplit 1
+ acceleration/energy drift too large 3.62203937128740
+ 20.0320284014358 split increased to 2 itime 990751
+ itsplit 1
+ acceleration/energy drift too large 4.42295413564357
+ 10.6714381752827 split increased to 2 itime 992731
+ itsplit 1
+ acceleration/energy drift too large 7.57497282303292
+ 17.6580167906195 split increased to 2 itime 993382
+ itsplit 1
+ acceleration/energy drift too large 3.78003912651920
+ 10.2318302682778 split increased to 2 itime 994149
+ itsplit 1
+ acceleration/energy drift too large 1.70558181148873
+ 11.2124394008163 split increased to 2 itime 996592
+ itsplit 1
+ acceleration/energy drift too large 1.98152789335267
+ 10.0315596865563 split increased to 2 itime 998563
+ itsplit 1
+ acceleration/energy drift too large 3.31628517915314
+ 23.0713856251341 split increased to 2 itime 999178
+ itsplit 1
+ acceleration/energy drift too large 7.41509555887398
+ 28.0813685506388 split increased to 2 itime 999369
+ itsplit 1
+ REMD synchro at 1000000
+ ntwx_cache 1 1 1 1 1 1 1 1
+ MIN ii_write= 1
+ writing restart at the end of run
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 1.56250E-02
+ Energy & gradient evaluation: 3.36891E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.96145E+02
+
+
+============================ End of MD calculation ===========================
+CG processor 0 is finishing work.
+ Total wall clock time 396.207031250000 sec
projects / unres.git / blobdiff