FermionΒΆ
Functions for the study of fermionic systems.
Convert bitstrings (rows) in a |
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Apply the set of transition operators to the configurations represented in |
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Flip an orbital occupancy array to match the indexing of a bitstring. |
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Approximate the ground state given molecular integrals and a set of electronic configurations. |
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Optimize orbitals to produce a minimal ground state. |
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Perform a similarity transform on the integrals. |
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Convert a bitstring matrix into a sorted array of unique, unsigned integers. |