energy/virial flags with CENTROID enum
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@ -36,7 +36,6 @@
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#include "memory.h"
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#include "error.h"
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using namespace LAMMPS_NS;
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#define MAXLINE 1024
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@ -63,6 +62,7 @@ PairEDIP::PairEDIP(LAMMPS *lmp) :
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restartinfo = 0;
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one_coeff = 1;
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manybody_flag = 1;
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centroidstressflag = CENTROID_NOTAVAIL;
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nelements = 0;
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elements = nullptr;
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