Accurate Single-Center Expansions Using Slater-Type Orbitals: Hydrogen Molecule
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Abstract
References (23)
The algebraic eigenvalue problem
1965 • 5,953 citations
The Energy Levels of a Rotating Vibrator
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Potential-Energy Curves for the X 1Σg+, b3Σu+, and C 1Πu States of the Hydrogen Molecule
1965 • 1,371 citations
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1964 • 638 citations
Configuration Interaction in Simple Atomic Systems
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Extended Hartree—Fock Wavefunctions: Optimized Valence Configurations for H2 and Li2, Optimized Double Configurations for F2
1966 • 422 citations
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1966 • 192 citations
The Nature of the Two-Electron Chemical Bond. III. Natural Orbitals for<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>
1963 • 68 citations
One-Center Wavefunction for the Ground State of the HeH+ Molecular Ion
1964 • 60 citations
Improved one-centre wave functions for the hydrogen and methane molecules
1963 • 52 citations
Correlation Splitting in the Hydrogen Molecule
1962 • 38 citations
On One-Center Expansions in H2+
1965 • 34 citations
Diatomic Forces and Force Constants. I. Errors in the Hellmann—Feynman Method
1966 • 34 citations
Electron Correlation and Electron-Pair Wavefunction for the Beryllium Atom
1965 • 31 citations
Some Excited States of the Hydrogen Molecule. II. 1Πg(1s2pπ), 3Πg(1s2pπ), 1Δg(1s3dδ), 3Δg(1s3dδ), 1Δu(1s3dδ), 3Δu(1s3dδ)
1964 • 27 citations
On the solution of the quantum mechanical two-electron problem by direct calculation of the natural orbitals
1966 • 23 citations
Accurate Single-Center Expansions with Slater-Type Orbitals: Hydrogen Atom and Hydrogen Molecule—Ion
1967 • 21 citations
Single-Center Calculations on the Lowest-Lying Πu and Πg Excited States of H2
1966 • 14 citations
Single-Center Wavefunctions for H3+ and H3
1967 • 11 citations
Single-Center Calculations on the 2IIu Excited State of H2+
1966 • 11 citations
Molecular Orbital Description of the Lowest Excited 1Σg+ State of H2
1964 • 8 citations
Intensity of the Quadrupole Fundamental of Molecular Hydrogen. Rotation—Vibration Interaction Correction
1964 • 7 citations
The variation of the quadrupole moment of H2 with internuclear distance, as given by some one center wave functions
1965 • 4 citations