0.01s
Test: XDRF2PDB-three
(Passed)
Build: Linux-gfortan-MPI GAB
(m10)
on 2023-05-29 03:07:11
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6
Show Command Line/tmp/cdash/build/bin/xdrf2pdb "three" "ala10three.seq" "ala10MD.cx"
Show Test Time Graph
Show Failing/Passing Graph
Test output nnt 2 nct 11
fileala10MD.cx
iret 1
is 1 ie 1000000000
time 89.6609344 iret 1
potE -8.83543396 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 167.907806 iret 1
potE -6.94359493 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 246.410934 iret 1
potE 1.05689478 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 314.487488 iret 1
potE -2.46591592 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 387.481262 iret 1
potE -6.69916487 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 455.685944 iret 1
potE -5.76471138 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 521.703918 iret 1
potE -5.88978624 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 579.347656 iret 1
potE -2.19257736 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 639.104675 iret 1
potE -3.36588764 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 716.453918 iret 1
potE 4.81506872 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 799.641418 iret 1
potE -7.30261183 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 868.575806 iret 1
potE -10.6498823 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 935.057800 iret 1
potE -6.10525322 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 1018.76404 iret 1
potE -4.24061155 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 1095.07739 iret 1
potE -2.74488902 uconst 0.00000000
uconst_back 0.0000000000000000
t_bath 300.000000
nss 0
nfrag 0
time 1095.07739 iret 0
