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Update orbitalwise analysis #300
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Updated condensed bonding analysis output for a single siteDescription textUpdated output of
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Hi @JaGeo , I have added the example outputs now. Can also share other calculation outputs if desired. Just shared the output from one of the test files. |
Could you test some more complex examples including d and f orbitals? Thx! @naik-aakash |
@naik-aakash Should I directly release another version? |
Hi @JaGeo , wait I need to raise another PR with the kpoints note update in the docs |
Closes #258
Changes
Todo