Add missing molecule_flag=1 in atom_vec_bond_kokkos

2019-05-04 17:42:21 -04:00
parent 97ce76e759
commit 81d3fa77bb
1 changed files with 2 additions and 0 deletions
--- a/src/KOKKOS/atom_vec_bond_kokkos.cpp
+++ b/src/KOKKOS/atom_vec_bond_kokkos.cpp
@ -43,6 +43,8 @@ AtomVecBondKokkos::AtomVecBondKokkos(LAMMPS *lmp) : AtomVecKokkos(lmp)
  size_data_vel = 4;
  xcol_data = 4;

+  atom->molecule_flag = 1;
+
  k_count = DAT::tdual_int_1d("atom::k_count",1);
  atomKK = (AtomKokkos *) atom;
  commKK = (CommKokkos *) comm;