Resolutions of the Coulomb operator Part III.Reduced-rank Schroedinger equations
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Limpanuparb, Taweetham
Gill, Peter
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Royal Society of Chemistry
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We consider a modified Schrödinger equation wherein the electron-electron repulsion terms rij-1 are approximated by truncated one-particle resolutions. Numerical results for the He atom and H2 molecule at the Hartree-Fock, second-order Møller-Plesset, a
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Physical Chemistry Chemical Physics
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2037-12-31