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Update pair_lj_class2_coul_cut.cpp

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Evangelos Voyiatzis
2018-12-17 18:03:25 +01:00
committed by GitHub
parent 968e56694f
commit d91c7f38f6
1 changed files with 14 additions and 0 deletions
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14
src/CLASS2/pair_lj_class2_coul_cut.cpp
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@ -14,6 +14,7 @@
#include <cmath>
#include <cstdio>
#include <cstdlib>
#include <cstring>
#include "pair_lj_class2_coul_cut.h"
#include "atom.h"
#include "comm.h"
@ -466,3 +467,16 @@ double PairLJClass2CoulCut::single(int i, int j, int itype, int jtype,
return eng;
}
/* ---------------------------------------------------------------------- */
void *PairLJClass2CoulCut::extract(const char *str, int &dim)
{
dim = 0;
if (strcmp(str,"cut_coul") == 0) return (void *) &cut_coul;
dim = 2;
if (strcmp(str,"epsilon") == 0) return (void *) epsilon;
if (strcmp(str,"sigma") == 0) return (void *) sigma;
return NULL;
}