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update pace plugin loader to include the two additional styles added

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This commit is contained in:
Axel Kohlmeyer
2024-09-03 22:30:32 -04:00
parent 9243959ca4
commit e240619b94
2 changed files with 38 additions and 2 deletions
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32
examples/PACKAGES/pace/plugin/paceplugin.cpp
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@ -3,6 +3,8 @@
#include "version.h"
#include "pair_pace.h"
#include "pair_pace_extrapolation.h"
#include "compute_pace.h"
using namespace LAMMPS_NS;
@ -11,6 +13,16 @@ static Pair *pair_pace_creator(LAMMPS *lmp)
return new PairPACE(lmp);
}
static Pair *pair_pace_extrapolation_creator(LAMMPS *lmp)
{
return new PairPACEExtrapolation(lmp);
}
static Compute *compute_pace_creator(LAMMPS *lmp, int argc, char **argv)
{
return new ComputePACE(lmp, argc, argv);
}
extern "C" void lammpsplugin_init(void *lmp, void *handle, void *regfunc)
{
lammpsplugin_t plugin;
@ -25,4 +37,24 @@ extern "C" void lammpsplugin_init(void *lmp, void *handle, void *regfunc)
plugin.creator.v1 = (lammpsplugin_factory1 *) &pair_pace_creator;
plugin.handle = handle;
(*register_plugin)(&plugin, lmp);
// register pace/extrapolation pair style
plugin.version = LAMMPS_VERSION;
plugin.style = "pair";
plugin.name = "pace/extrapolation";
plugin.info = "PACE plugin extrapolation pair style v1.0";
plugin.author = "Axel Kohlmeyer (akohlmey@gmail.com)";
plugin.creator.v1 = (lammpsplugin_factory1 *) &pair_pace_extrapolation_creator;
plugin.handle = handle;
(*register_plugin)(&plugin, lmp);
// register pace compute style
plugin.version = LAMMPS_VERSION;
plugin.style = "compute";
plugin.name = "pace";
plugin.info = "PACE plugin compute style v1.0";
plugin.author = "Axel Kohlmeyer (akohlmey@gmail.com)";
plugin.creator.v2 = (lammpsplugin_factory2 *) &compute_pace_creator;
plugin.handle = handle;
(*register_plugin)(&plugin, lmp);
}