rdmc.external.logparser.gaussian#
- class rdmc.external.logparser.gaussian.GaussianLog(path: str, job_type: list | None = None, ts: bool | None = None)#
Bases:
CclibLogA class helps to parse the Gaussian log files and provides information helpful to analyze the calculation.
- opt_criteria = ['Force Maximum', 'Force RMS', 'Displacement Maximum', 'Displacement RMS']#
- time_regex = '[a-zA-Z]+\\s+\\d+\\s+\\d{2}\\:\\d{2}\\:\\d{2}\\s+\\d{4}'#