pwtools.io.read_cp2k_md¶
- pwtools.io.read_cp2k_md = <pwtools.io.ReadFactory object>¶
Read CP2K MD run ouput (all text).
- Parameters:
filename (str) – Name of the file to parse.
**kwds (keywords args) – passed to the parser class (e.g. units=…)
- Returns:
ret
- Return type:
Structure
(SCF runs) orTrajectory
(MD-like runs)