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Merge pull request #431 from v0i0/fix-airebo-morse

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Fix airebo/morse
This commit is contained in:
sjplimp
2017-03-24 10:03:29 -06:00
committed by GitHub
parent f5a85d68ad 5c9892c083
commit e6fcaefe95
2 changed files with 2 additions and 16 deletions
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9
src/MANYBODY/pair_airebo_morse.cpp
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@ -27,14 +27,7 @@ PairAIREBOMorse::PairAIREBOMorse(LAMMPS *lmp) : PairAIREBO(lmp) {}
void PairAIREBOMorse::settings(int narg, char **arg) void PairAIREBOMorse::settings(int narg, char **arg)
{ {
if (narg != 1 && narg != 3) error->all(FLERR,"Illegal pair_style command"); PairAIREBO::settings(narg,arg);
cutlj = force->numeric(FLERR,arg[0]);
if (narg == 3) {
ljflag = force->inumeric(FLERR,arg[1]);
torflag = force->inumeric(FLERR,arg[2]);
}
morseflag = 1; morseflag = 1;
} }

9
src/USER-OMP/pair_airebo_morse_omp.cpp
View File

@ -27,14 +27,7 @@ PairAIREBOMorseOMP::PairAIREBOMorseOMP(LAMMPS *lmp) : PairAIREBOOMP(lmp) {}
void PairAIREBOMorseOMP::settings(int narg, char **arg) void PairAIREBOMorseOMP::settings(int narg, char **arg)
{ {
if (narg != 1 && narg != 3) error->all(FLERR,"Illegal pair_style command"); PairAIREBOOMP::settings(narg,arg);
cutlj = force->numeric(FLERR,arg[0]);
if (narg == 3) {
ljflag = force->inumeric(FLERR,arg[1]);
torflag = force->inumeric(FLERR,arg[2]);
}
morseflag = 1; morseflag = 1;
} }