Solution of the Hartree-Fock problem by expansion onto nested bases-Reference-Cited by-同舟云学术

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Solution of the Hartree-Fock problem by expansion onto nested bases

Published:1970-05 Issue:3 Volume:4 Page:245-255
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Marron M. T.,Handy N. C.,Parr R. G.,Silverstone H. J.

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference5 articles.

1. New Developments in Molecular Orbital Theory

2. Self-Consistent Field Theory for Open Shells of Electronic Systems

3. Quantum Theory of Atomic Structure (McGraw-Hill, New York, 1966), Vol. 2, p. 11 ff.

4. Long-Range Behavior of Hartree-Fock Orbitals

5. Ab Initio Computations in Atoms and Molecules

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1. Nodes in Hartree-Fock 1s atomic orbitals caused by exchange interactions;Computational and Theoretical Chemistry;2021-10

2. Artificial nodes in the H 2 + wave functions expanded using Gaussian-type orbitals or Laguerre-type orbitals;Computational and Theoretical Chemistry;2017-03

3. A Program for Single-center Expansion in Laguerre-type Orbitals for the Hydrogen Molecular Ion;Journal of Computer Chemistry, Japan -International Edition;2016

4. Counting nodal surfaces in molecular orbitals: Elimination of artificial nodes;Computational and Theoretical Chemistry;2014-10

5. Zero potential energy criterion applied to Hartree–Fock wave functions;The Journal of Chemical Physics;1988-10

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