Molecular properties and basis set quality: An approach based on information theory
- 1 January 1981
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 19 (1) , 43-60
- https://doi.org/10.1002/qua.560190106
Abstract
No abstract availableKeywords
This publication has 17 references indexed in Scilit:
- Structural studies using molecular orbital theoryBulletin des Sociétés Chimiques Belges, 1976
- Gaussian Basis Functions for Use in Molecular Calculations. III. Contraction of (10s6p) Atomic Basis Sets for the First-Row AtomsThe Journal of Chemical Physics, 1971
- Gaussian-Type Functions for Polyatomic Systems. IIIThe Journal of Chemical Physics, 1970
- Electronic Structure of Diatomic Molecules. VI.A. Hartree—Fock Wavefunctions and Energy Quantities for the Ground States of the First-Row Hydrides, AHThe Journal of Chemical Physics, 1967
- Gaussian-Type Functions for Polyatomic Systems. IThe Journal of Chemical Physics, 1965
- Stark Effect and Hyperfine Structure of Hydrogen FluoridePhysical Review B, 1963
- Self-Consistent Field Theory for Open Shells of Electronic SystemsReviews of Modern Physics, 1960
- Self-Consistent Orbitals for RadicalsThe Journal of Chemical Physics, 1954
- SEMANTIC INFORMATIONThe British Journal for the Philosophy of Science, 1953
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951