write_jfile
Full name: ase2sprkkr.bindings.uppasd.write_jfile
- ase2sprkkr.bindings.uppasd.write_jfile(jxc_ouput_file, file_name=None, directory=None, selector=None, iq=None, it=None, exclude_it=None, exclude_vc=True, exchange_radius=None, coordinates=Coordinates.lattice)[source]
- Parameters:
jxc_ouput_file (JXCOutputFile)
coordinates (Coordinates)