[ase-users] cif file reading

Alaithan, Zainab z.alaithan17 at imperial.ac.uk
Thu Jun 25 19:43:27 CEST 2020


Dear ASE users,

I am reading a geometry cif file with _symmetry_cell_setting   of orthorhombic. This results in the following error:

UserWarning: crystal system 'orthorhombic' is not interpreted for space group Spacegroup(63, setting=1). This may result in wrong setting!

Does any body know why the setting of orthorhombic is not defined or how to fix this?

Regards,

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