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12 lines
473 B
ReStructuredText
12 lines
473 B
ReStructuredText
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=============
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non_h_ints_mu
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=============
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Computes the non hermitian potential of the mu-TC Hamiltonian on the AO and BI-ORTHO MO basis.
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The operator is defined in Eq. 33 of JCP 154, 084119 (2021)
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The two providers are :
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+) ao_non_hermit_term_chemist which returns the non hermitian part of the two-electron TC Hamiltonian on the MO basis.
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+) mo_non_hermit_term_chemist which returns the non hermitian part of the two-electron TC Hamiltonian on the BI-ORTHO MO basis.
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