forked from lijiext/lammps
30 lines
1010 B
Groff
30 lines
1010 B
Groff
LAMMPS (14 Jun 2014)
|
|
Lattice spacing in x,y,z = 4.43 4.43 4.43
|
|
Created orthogonal box = (0 0 0) to (88.6 88.6 88.6)
|
|
1 by 1 by 1 MPI processor grid
|
|
Created 32000 atoms
|
|
Setting up run ...
|
|
Memory usage per processor = 9.18789 Mbytes
|
|
Step Temp E_pair E_mol TotEng Press
|
|
0 200 -741.55469 0 85.684388 -34.939092
|
|
100 108.37517 -362.56658 0 85.694308 3963.7892
|
|
Loop time of 2.93267 on 1 procs for 100 steps with 32000 atoms
|
|
|
|
Pair time (%) = 2.53716 (86.5136)
|
|
Neigh time (%) = 0.316884 (10.8053)
|
|
Comm time (%) = 0.0216067 (0.736757)
|
|
Outpt time (%) = 0.000198126 (0.00675581)
|
|
Other time (%) = 0.0568225 (1.93757)
|
|
|
|
Nlocal: 32000 ave 32000 max 32000 min
|
|
Histogram: 1 0 0 0 0 0 0 0 0 0
|
|
Nghost: 20131 ave 20131 max 20131 min
|
|
Histogram: 1 0 0 0 0 0 0 0 0 0
|
|
Neighs: 1.88909e+06 ave 1.88909e+06 max 1.88909e+06 min
|
|
Histogram: 1 0 0 0 0 0 0 0 0 0
|
|
|
|
Total # of neighbors = 1889091
|
|
Ave neighs/atom = 59.0341
|
|
Neighbor list builds = 5
|
|
Dangerous builds = 0
|