git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13951 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2015-08-28 23:36:43 +00:00
parent 0f3d77ed75
commit 4e247c3b8c
7 changed files with 44 additions and 11 deletions

View File

@ -244,7 +244,12 @@ void FixTempCSVR::end_of_step()
const double ekin_old = t_current * efactor;
const double ekin_new = t_target * efactor;
// there is nothing to do, if there are no degrees of freedom
if (temperature->dof < 1) return;
// compute velocity scaling factor on root node and broadcast
double lamda;
if (comm->me == 0) {
lamda = resamplekin(ekin_old, ekin_new);