ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

bugfix from @jtclem for molecule files with multiple molecule IDs

Browse Source
This commit is contained in:
Axel Kohlmeyer
2025-01-31 20:32:58 -05:00
parent 7d7cdf3e08
commit 1dc5f8739a
1 changed files with 1 additions and 1 deletions
Download Patch File Download Diff File Expand all files Collapse all files

2
src/create_atoms.cpp
View File

@ -523,7 +523,7 @@ void CreateAtoms::command(int narg, char **arg)
// molcreate = # of molecules I created // molcreate = # of molecules I created
tagint molcreate = (atom->nlocal - nlocal_previous) / onemol->natoms * onemol->nmolecules; tagint molcreate = (atom->nlocal - nlocal_previous) / onemol->natoms;
// increment total bonds,angles,etc // increment total bonds,angles,etc