ICODE-ADC/lammps
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Merge remote-tracking branch 'lammps/master' into kim-simulator-models

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This commit is contained in:
Ellad Tadmor
2019-06-24 15:35:06 -05:00
parent 86d878a7eb c79044c361
commit 483353a017
446 changed files with 64659 additions and 9735 deletions
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19
src/modify.cpp
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@ -81,6 +81,11 @@ Modify::Modify(LAMMPS *lmp) : Pointers(lmp)
ncompute = maxcompute = 0;
compute = NULL;
create_factories();
}
void _noopt Modify::create_factories()
{
// fill map with fixes listed in style_fix.h
fix_map = new FixCreatorMap();
@ -893,11 +898,8 @@ void Modify::add_fix(int narg, char **arg, int trysuffix)
fix[ifix] = fix_creator(lmp,narg,arg);
}
if (fix[ifix] == NULL) {
char str[128];
snprintf(str,128,"Unknown fix style %s",arg[2]);
error->all(FLERR,str);
}
if (fix[ifix] == NULL)
error->all(FLERR,utils::check_packages_for_style("fix",arg[2],lmp).c_str());
// check if Fix is in restart_global list
// if yes, pass state info to the Fix so it can reset itself
@ -1195,11 +1197,8 @@ void Modify::add_compute(int narg, char **arg, int trysuffix)
compute[ncompute] = compute_creator(lmp,narg,arg);
}
if (compute[ncompute] == NULL) {
char str[128];
snprintf(str,128,"Unknown compute style %s",arg[2]);
error->all(FLERR,str);
}
if (compute[ncompute] == NULL)
error->all(FLERR,utils::check_packages_for_style("compute",arg[2],lmp).c_str());
ncompute++;
}