Batch featurizer breaks down when gz file for POSCAR does not exist
naik-aakash opened this issue · 0 comments
naik-aakash commented
Better handling of POSCAR files checks needs to implemented. Current implementation just replaces with POSCAR.lobster if POSCAR.gz file does not exist.
Expected behaviour
Ideally it should check if POSCAR file exist before replacing it with POSCAR.lobster in the code