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20212024
most citedDensity Matrices of Seniority-Zero Geminal Wavefunctions

24 citations · 47 across the 5 of their papers we have counts for

collaborators

5 papers

physics.chem-ph2024

Singlet Geminal Wavefunctions

Paul A. Johnson, Jean-David Moisset, Marianne Gratton +8

Wavefunction forms based on products of electron pairs are usually constructed as closed-shell singlets, which is insufficient when the molecular state has a nonzero spin or when t…

physics.chem-ph2022★ 22 cited

Reduced Density Matrices / Static Correlation Functions of Richardson-Gaudin States Without Rapidities

Alexandre Faribault, Claude Dimo, Jean-David Moisset +1

Seniority-zero geminal wavefunctions are known to capture bond-breaking correlation. Among this class of wavefunctions, Richardson-Gaudin states stand out as they are eigenvectors…

physics.chem-ph2022★ 1 cited

Near-exact treatment of seniority-zero ground and excited states with a Richardson-Gaudin mean-field

Charles-Émile Fecteau, Samuel Cloutier, Jean-David Moisset +4

Eigenvectors of the reduced Bardeen-Cooper-Schrieffer Hamiltonian, Richardson-Gaudin (RG) states, are used as a variational wavefunction Ansatz for strongly-correlated electronic s…

physics.chem-ph2022★ 24 cited

Density Matrices of Seniority-Zero Geminal Wavefunctions

Jean-David Moisset, Charles-Émile Fecteau, Paul A. Johnson

Scalar products and density matrix elements of closed-shell pair geminal wavefunctions are evaluated directly in terms of the pair amplitudes, resulting in an analogue of Wick's th…

physics.chem-ph2021

Perturbative corrections for Hartree-Fock-like Algebraic Bethe Ansatz analogue

Jean-David Moisset, Laurie Carrier, Paul A. Johnson

Rayleigh Schrödinger perturbation theory corrections are developed for an algebraic Bethe ansatz of individual electrons. Numerical results are ambiguous and would need either an o…