Small cleanup

2023-01-03 10:09:47 -07:00
parent 295d8a6903
commit a3572b61d8
3 changed files with 64 additions and 71 deletions
--- a/src/ML-PACE/pair_pace_extrapolation.cpp
+++ b/src/ML-PACE/pair_pace_extrapolation.cpp
@ -135,16 +135,12 @@ void PairPACEExtrapolation::compute(int eflag, int vflag)

  double **x = atom->x;
  double **f = atom->f;
-//  tagint *tag = atom->tag;
  int *type = atom->type;
  // number of atoms in cell
  int nlocal = atom->nlocal;

  int newton_pair = force->newton_pair;

-  // number of atoms including ghost atoms
-//  int nall = nlocal + atom->nghost;
-
  // inum: length of the neighborlists list
  inum = list->inum;