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

use new neighbor list request API

Browse Source
This commit is contained in:
Axel Kohlmeyer
2022-03-05 20:20:55 -05:00
parent 21fc072396
commit de4b9a1d20
1 changed files with 1 additions and 6 deletions
Download Patch File Download Diff File Expand all files Collapse all files

7
src/compute_aggregate_atom.cpp
View File

@ -84,12 +84,7 @@ void ComputeAggregateAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
// full required so that pair of atoms on 2 procs both set their clusterID // full required so that pair of atoms on 2 procs both set their clusterID
int irequest = neighbor->request(this,instance_me); neighbor->add_request(this,NeighConst::REQ_FULL|NeighConst::REQ_OCCASIONAL);
neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0;
neighbor->requests[irequest]->full = 1;
neighbor->requests[irequest]->occasional = 1;
int count = 0; int count = 0;
for (int i = 0; i < modify->ncompute; i++) for (int i = 0; i < modify->ncompute; i++)