git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11882 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2014-05-02 15:06:18 +00:00 · 2014-05-02 15:06:18 +00:00 · 54633e6252
parent 8e760279f7
commit 54633e6252
1 changed files with 4 additions and 0 deletions
--- a/src/ASPHERE/compute_temp_asphere.cpp
+++ b/src/ASPHERE/compute_temp_asphere.cpp
@ -158,9 +158,13 @@ void ComputeTempAsphere::dof_compute()

  if (tempbias == 1) {
    if (mode == ALL) dof -= tbias->dof_remove(-1) * natoms;
+
  } else if (tempbias == 2) {
    int *mask = atom->mask;
    int nlocal = atom->nlocal;
+
+    tbias->dof_remove_pre();
+
    int count = 0;
    for (int i = 0; i < nlocal; i++)
      if (mask[i] & groupbit)