update cauchystat example to conform more with standard LAMMPS examples

This commit is contained in:
Axel Kohlmeyer
2018-10-22 15:56:41 -04:00
parent 8f6f7eb4cd
commit baea04b913
3 changed files with 70018 additions and 70008 deletions

File diff suppressed because it is too large Load Diff

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@ -1,6 +1,6 @@
Run this example by executing:
% lmp -in lammps.in
% lmp -in in.cauchystat
Note that this example use an EAM potential, and therefore must be
run with a LAMMPS executable built with the MANYBODY package.

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@ -33,6 +33,8 @@ fix 1 all npt temp 600.0 600.0 1.0 &
dump 1 all cfg 1000 test*.cfg mass type xs ys zs type c_cna
info fixes
timestep 0.002
variable px equal pxx
@ -66,3 +68,11 @@ fix 1 all npt temp 600.0 600.0 1.0 &
couple none cauchystat 0.001 yes
run 10000
fix 1 all npt temp 600.0 600.0 1.0 &
x 0.0 0.0 0.1 &
y 0.0 0.0 0.1 &
z 0.0 0.0 0.1 &
xy -10000.0 -10000.0 0.1 &
couple none cauchystat 0.001 no
run 10000