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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15083 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2016-05-31 16:33:07 +00:00
parent 7e7450948c
commit 876b033ea8
96 changed files with 170 additions and 159 deletions
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4
src/fix_langevin.cpp
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@ -511,7 +511,7 @@ void FixLangevin::post_force_untemplated
// reallocate flangevin if necessary
if (Tp_TALLY) {
if (atom->nlocal > maxatom1) {
if (atom->nmax > maxatom1) {
memory->destroy(flangevin);
maxatom1 = atom->nmax;
memory->create(flangevin,maxatom1,3,"langevin:flangevin");
@ -641,7 +641,7 @@ void FixLangevin::compute_target()
error->one(FLERR,"Fix langevin variable returned negative temperature");
tsqrt = sqrt(t_target);
} else {
if (nlocal > maxatom2) {
if (atom->nmax > maxatom2) {
maxatom2 = atom->nmax;
memory->destroy(tforce);
memory->create(tforce,maxatom2,"langevin:tforce");