git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11328 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2014-01-25 22:46:08 +00:00
parent 2f6a46a2be
commit 0ce16af78b
63 changed files with 2943 additions and 798 deletions

View File

@ -163,6 +163,12 @@ int FixGPU::setmask()
void FixGPU::init()
{
// GPU package cannot be used with atom_style template
if (atom->molecular == 2)
error->all(FLERR,"GPU package does not (yet) work with "
"atom_style template");
// hybrid cannot be used with force/neigh option
if (_gpu_mode == GPU_NEIGH || _gpu_mode == GPU_HYB_NEIGH)
@ -188,7 +194,7 @@ void FixGPU::init()
force->pair->no_virial_fdotr_compute = 1;
}
// r-RESPA support
// rRESPA support
if (strstr(update->integrate_style,"respa"))
_nlevels_respa = ((Respa *) update->integrate)->nlevels;