Adding files for BPM

This commit is contained in:
Joel Thomas Clemmer
2021-08-27 09:22:56 -06:00
parent 3404920e98
commit bb720626e3
87 changed files with 5392 additions and 905 deletions

View File

@ -217,6 +217,9 @@ void Comm::init()
if (force->pair) maxforward = MAX(maxforward,force->pair->comm_forward);
if (force->pair) maxreverse = MAX(maxreverse,force->pair->comm_reverse);
if (force->bond) maxforward = MAX(maxforward,force->bond->comm_forward);
if (force->bond) maxreverse = MAX(maxreverse,force->bond->comm_reverse);
for (int i = 0; i < modify->nfix; i++) {
maxforward = MAX(maxforward,modify->fix[i]->comm_forward);
maxreverse = MAX(maxreverse,modify->fix[i]->comm_reverse);
@ -234,6 +237,7 @@ void Comm::init()
if (force->newton == 0) maxreverse = 0;
if (force->pair) maxreverse = MAX(maxreverse,force->pair->comm_reverse_off);
if (force->bond) maxreverse = MAX(maxreverse,force->bond->comm_reverse_off);
// maxexchange_atom = size of an exchanged atom, set by AtomVec
// only needs to be set if size > BUFEXTRA