forked from lijiext/lammps
30 lines
1007 B
Groff
30 lines
1007 B
Groff
|
LAMMPS (7 Aug 2013)
|
||
|
|
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 = 16.8628 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 4.71197 on 1 procs for 100 steps with 32000 atoms
|
||
|
|
|
||
|
|
Pair time (%) = 4.16929 (88.4831)
|
||
|
|
Neigh time (%) = 0.434233 (9.21553)
|
||
|
|
Comm time (%) = 0.0237658 (0.504371)
|
||
|
|
Outpt time (%) = 0.000121117 (0.0025704)
|
||
|
|
Other time (%) = 0.084554 (1.79445)
|
||
|
|
|
||
|
|
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
|