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add convertor test #15

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shivupa
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@shivupa shivupa commented Jan 16, 2024

This adds a test

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@amandadumi amandadumi left a comment

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This is perfect, thanks for adding it. Just a few questions. If you don't have bandwidith i can just approve and remove them myself, but wanted to be sure they weren't intentional.

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Does this empty file need to be here?

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not sure but its in the other pyscf test lol

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why are these named gold?

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idk it seemed like all the reference values are called gold? I guess like gold standard? Sorta confusing imo

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looks good thank you!

@amandadumi amandadumi merged commit c19d4a1 into amandadumi:pyscftoqmcpack_cas Jan 22, 2024
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