Commit 30babd81 authored by sjplimp's avatar sjplimp Committed by GitHub
Browse files

Merge pull request #485 from akohlmey/pair_settings_cut_bugfix

Bugfix for correct resetting of previously set cutoffs to various Pair::settings() functions
parents aa09f45b 51fc386e
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+1 −1
Original line number Diff line number Diff line
@@ -281,7 +281,7 @@ void PairGayBerne::settings(int narg, char **arg)
  if (allocated) {
    int i,j;
    for (i = 1; i <= atom->ntypes; i++)
      for (j = i+1; j <= atom->ntypes; j++)
      for (j = i; j <= atom->ntypes; j++)
        if (setflag[i][j]) cut[i][j] = cut_global;
  }
}
+1 −1
Original line number Diff line number Diff line
@@ -355,7 +355,7 @@ void PairLineLJ::settings(int narg, char **arg)
  if (allocated) {
    int i,j;
    for (i = 1; i <= atom->ntypes; i++)
      for (j = i+1; j <= atom->ntypes; j++)
      for (j = i; j <= atom->ntypes; j++)
        if (setflag[i][j]) cut[i][j] = cut_global;
  }
}
+1 −1
Original line number Diff line number Diff line
@@ -253,7 +253,7 @@ void PairRESquared::settings(int narg, char **arg)
  if (allocated) {
    int i,j;
    for (i = 1; i <= atom->ntypes; i++)
      for (j = i+1; j <= atom->ntypes; j++)
      for (j = i; j <= atom->ntypes; j++)
        if (setflag[i][j]) cut[i][j] = cut_global;
  }
}
+1 −1
Original line number Diff line number Diff line
@@ -426,7 +426,7 @@ void PairTriLJ::settings(int narg, char **arg)
  if (allocated) {
    int i,j;
    for (i = 1; i <= atom->ntypes; i++)
      for (j = i+1; j <= atom->ntypes; j++)
      for (j = i; j <= atom->ntypes; j++)
        if (setflag[i][j]) cut[i][j] = cut_global;
  }
}
+1 −1
Original line number Diff line number Diff line
@@ -372,7 +372,7 @@ void PairBody::settings(int narg, char **arg)
  if (allocated) {
    int i,j;
    for (i = 1; i <= atom->ntypes; i++)
      for (j = i+1; j <= atom->ntypes; j++)
      for (j = i; j <= atom->ntypes; j++)
        if (setflag[i][j]) cut[i][j] = cut_global;
  }
}
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