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ENH: Inconsistency when testings spin and seniority in ehCI wavefunctions #15

@carlosevmoura

Description

@carlosevmoura

Describe the new feature:

The actual fanpy.tools.satisfies_conditions function cannot correctly assign valid spins and seniorities for SDs in extended-hierarchy CI wavefunctions.****

How would you implement this feature?

I plan to add a flag as an argument in fanpy.tools.satisfies_conditions and fanpy.tools.sd_lists to hierarchy constructions and check conditions properly. It also requires changes in the ehCI wavefunctions actually implemented.

Additional comments:

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