ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

Atom data will not be copied multiple times if multiple styles need it.

Browse Source 
Adding back missing extern from nbor.
This commit is contained in:
W. Michael Brown
2011-01-24 17:33:38 -05:00
parent 6018dd02b1
commit 45971bf732
3 changed files with 104 additions and 69 deletions
Download Patch File Download Diff File Expand all files Collapse all files

6
lib/gpu/pair_gpu_atom.cpp
View File

@ -183,6 +183,9 @@ bool PairGPUAtomT::init(const int inum, const int nall, const bool charge,
clear();
bool success=true;
_x_avail=false;
_q_avail=false;
_quat_avail=false;
_gpu_nbor=gpu_nbor;
_bonds=bonds;
_charge=charge;
@ -516,6 +519,9 @@ double PairGPUAtomT::energy_virial(double *eatom, double **vatom,
template <class numtyp, class acctyp>
void PairGPUAtomT::get_answers(double **f, double **tor) {
_x_avail=false;
_q_avail=false;
_quat_avail=false;
acctyp *ap=host_ans.begin();
if (_gpu_nbor) {
for (int i=0; i<_inum; i++) {