Comment on ‘‘Valence-bond theory and the evaluation of electronic energy matrix elements between nonorthogonal Slater determinants’’

G. A. Gallup · Physical Review A · 1986

In a recent article [Phys. Rev. A 31, 2107 (1985)] Leasure and Balint-Kurti claim to give a more efficient algorithm than any previously available for determining matrix elements of the Hamiltonian in valence-bond calculations. Actually, an algorithm of no significant difference and the same efficiency has been available since 1972 and has been applied to valence-bond calculations.

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