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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4685 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2010-09-03 23:12:51 +00:00
parent 0916c0fa16
commit 5810937ea9
8 changed files with 67 additions and 26 deletions
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7
src/min.cpp
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@ -229,7 +229,8 @@ void Min::setup()
ev_set(update->ntimestep);
force_clear();
modify->setup_pre_force(vflag);
if (force->pair) force->pair->compute(eflag,vflag);
if (atom->molecular) {
@ -299,7 +300,8 @@ void Min::setup_minimal(int flag)
ev_set(update->ntimestep);
force_clear();
modify->setup_pre_force(vflag);
if (force->pair) force->pair->compute(eflag,vflag);
if (atom->molecular) {
@ -454,6 +456,7 @@ double Min::energy_force(int resetflag)
ev_set(update->ntimestep);
force_clear();
if (modify->n_min_pre_force) modify->min_pre_force(vflag);
timer->stamp();