Execution Time0.01s

Test: XDRF2PDB-three (Passed)
Build: Linux-gfortan-MPI GAB (m10) on 2023-05-24 03:07:11
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6

Processors[Graph]1

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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