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

disallow usage of qeq fixes with incompatible GPU and USER-INTEL packages

Browse Source
This commit is contained in:
Axel Kohlmeyer
2021-04-20 14:51:05 -04:00
parent 799fb284c8
commit fe2efa4cb3
3 changed files with 11 additions and 3 deletions
Download Patch File Download Diff File Expand all files Collapse all files

4
src/pair_hybrid.cpp
View File

@ -948,9 +948,7 @@ void PairHybrid::modify_special(int m, int /*narg*/, char **arg)
special[2] = utils::numeric(FLERR,arg[2],false,lmp);
special[3] = utils::numeric(FLERR,arg[3],false,lmp);
// have to cast to PairHybrid to work around C++ access restriction
if (((PairHybrid *)styles[m])->suffix_flag & (Suffix::INTEL|Suffix::GPU))
if (styles[m]->suffix_flag & (Suffix::INTEL|Suffix::GPU))
error->all(FLERR,"Pair_modify special is not compatible with "
"suffix version of hybrid substyle");