Numerical Calculation of H2+ and H2 Wavefunctions
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Abstract
References (10)
Accurate Electronic Wave Functions for the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">H</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>Molecule
1960 • 692 citations
The Ground State of the Hydrogen Molecule
1933 • 609 citations
A Study of Two-Center Integrals Useful in Calculations on Molecular Structure. II. The Two-Center Exchange Integrals
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Local-Energy Method in Electronic Energy Calculations
1960 • 108 citations
The Approximate Solution of Schrödinger Equations by a Least Squares Method
1942 • 98 citations
Least-Squares Local-Energy Method for Molecular Energy Calculations Using Gauss Quadrature Points
1961 • 41 citations
Energy of the Lithium Atom by the Least-Squares Local Energy Method
1963 • 28 citations
Electronic Energy of the Hydrogen Molecule Ground State by the Local-Energy Method
1964 • 27 citations
Energies of the lowest singlet S and triplet S states of helium by the local energy method
1963 • 17 citations
Hermiticity and Gaussian Quadrature
1964 • 7 citations