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energy/virial flags with CENTROID enum

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This commit is contained in:
Steve Plimpton
2020-11-18 12:17:14 -07:00
parent 35035189e6
commit 0876684780
74 changed files with 362 additions and 262 deletions
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2
src/pair_morse.cpp
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@ -22,7 +22,6 @@
#include "memory.h"
#include "error.h"
using namespace LAMMPS_NS;
/* ---------------------------------------------------------------------- */
@ -30,7 +29,6 @@ using namespace LAMMPS_NS;
PairMorse::PairMorse(LAMMPS *lmp) : Pair(lmp)
{
writedata = 1;
centroidstressflag = CENTROID_SAME;
}
/* ---------------------------------------------------------------------- */