Package to perform automatic bonding analysis with the program Lobster in the field of computational materials science and quantum chemistry
BSD 3-Clause "New" or "Revised" License
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Lobsterpy does not work if only POSCAR.lobster exists #254
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JaGeo closed 6 months ago
If there is no POSCAR but a POSCAR.lobster, lobsterpy does not work. Providing -fstruct does not work here.