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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10472 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2013-07-29 19:57:01 +00:00
parent 3445e262ad
commit 4d4622ab17
1 changed files with 4 additions and 7 deletions
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11
src/fix_langevin.cpp
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@ -534,15 +534,12 @@ void FixLangevin::post_force_untemplated
if (Tp_BIAS) {
temperature->remove_bias(i,v[i]);
fdrag[0] = gamma1*v[i][0];
fdrag[1] = gamma1*v[i][1];
fdrag[2] = gamma1*v[i][2];
fdrag[0] = gamma1*v[i][0];
if (v[i][0] != 0.0) f[i][0] += fdrag[0] + fran[0];
else fran[0] = 0.0;
if (v[i][1] != 0.0) f[i][1] += fdrag[1] + fran[1];
else fran[1] = 0.0;
if (v[i][2] != 0.0) f[i][2] += fdrag[2] + fran[2];
else fran[2] = 0.0;
if (v[i][0] == 0.0) fran[0] = 0.0;
if (v[i][1] == 0.0) fran[1] = 0.0;
if (v[i][2] == 0.0) fran[2] = 0.0;
temperature->restore_bias(i,v[i]);
} else {
fdrag[0] = gamma1*v[i][0];