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initialization bug

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This commit is contained in:
Jacob Gissinger
2025-02-09 15:26:07 -05:00
parent 6f19d1fe0e
commit 05521d38d9
1 changed files with 1 additions and 1 deletions
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2
src/REACTION/fix_bond_react.cpp
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@ -3153,7 +3153,7 @@ void FixBondReact::update_everything()
// find current max molecule ID and shift for each proc
tagint moloffset = 0;
if (molid_mode == Reset_mol_ids::Molmap) {
tagint maxmol_all;
tagint maxmol_all = 0;
for (int i = 0; i < atom->nlocal; i++) maxmol_all = MAX(maxmol_all, atom->molecule[i]);
MPI_Allreduce(MPI_IN_PLACE, &maxmol_all, 1, MPI_LMP_TAGINT, MPI_MAX, world);
// find number of new molids needed for each proc