Allow user kpoints in NSCF calculations #1427
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Need unittests. |
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The tests failed. |
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THanks. |
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Summary
Users were not able to supply their own kpoints settings in NSCF calculations. This pull request allows for a Kpoints object to override the Kpoints object generated by default by pymatgen.
This was an issue raised in atomate (hackingmaterials/atomate#278)