Skip to content

Commit

Permalink
documentation modified
Browse files Browse the repository at this point in the history
  • Loading branch information
hjung committed Jul 30, 2024
1 parent 7687435 commit 707072a
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion wfl/generate/md/__init__.py
Original file line number Diff line number Diff line change
Expand Up @@ -84,7 +84,7 @@ def _sample_autopara_wrappable(atoms, calculator, steps, dt, integrator="NVTBere
random number generator to use (needed for pressure sampling, initial temperature, or Langevin dynamics)
logger_kwargs: dict, default None
kwargs to MDLogger to attach to each MD run, including "logfile" as string to which
config number will be appended
config number will be appended. User defined ase.md.MDLogger derived class can be provided with "logger" as key.
logger_interval: int, default None
interval for logger
_autopara_per_item_info: dict
Expand Down

0 comments on commit 707072a

Please sign in to comment.