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Hartree-Fock-Bogoliubov theory for number-parity-violating fermionic Hamiltonians.

Thomas M Henderson1,2, Shadan Ghassemi Tabrizi1, Guo P Chen1

  • 1Department of Chemistry, Rice University, Houston, Texas 77005-1892, USA.

The Journal of Chemical Physics
|February 11, 2024
PubMed
Summary

Physical Hamiltonians for fermions typically require an even number of operators. This study extends Hartree-Fock-Bogoliubov (HFB) theory to handle an odd number of operators, crucial for Jordan-Wigner transformations in quantum chemistry.

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