A multi-configuration Hartree-Fock program
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Abstract
References (15)
Ab Initio Computations in Atoms and Molecules
1965 • 1,526 citations
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1960 • 648 citations
The calculation of atomic structures
1958 • 459 citations
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1962 • 294 citations
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1962 • 294 citations
NUMERICAL SOLUTION OF THE HARTREE–FOCK EQUATIONS
1963 • 250 citations
Simple Basis Set for Molecular Wavefunctions Containing First- and Second-Row Atoms
1964 • 245 citations
HARTREE–FOCK WAVE FUNCTIONS FOR EXCITED STATES: THE 2 1S STATE OF HELIUM
1965 • 46 citations
HARTREE–FOCK WAVE FUNCTIONS FOR EXCITED STATES: II. SIMPLIFICATION OF THE ORBITAL EQUATIONS
1966 • 35 citations
The Effect of Configuration Interaction on the Transition Integral.
1965 • 33 citations
Superposition of Configuration Results for SI II
1968 • 31 citations
Hartree-Fock Results for Some Excited States of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo><mml:mn>2</mml:mn><mml:mn /></mml:mrow></mml:msup></mml:mrow></mml:math>,<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></…
1965 • 20 citations
THE ORTHOGONALITY ASSUMPTION IN THE HARTREE–FOCK APPROXIMATION
1967 • 19 citations
LIMITING SCREENING NUMBERS AND ENERGY PARAMETERS
1963 • 8 citations
Praktische Lösung von Eigenwertaufgaben des Hartree‐Fockschen Typs
1958 • 3 citations