Extended basis set studies of hydrocarbon molecular orbital energies
- 15 October 1975
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 36 (1) , 1-5
- https://doi.org/10.1016/0009-2614(75)85672-7
Abstract
No abstract availableKeywords
This publication has 10 references indexed in Scilit:
- The influence of polarization functions on molecular orbital hydrogenation energiesTheoretical Chemistry Accounts, 1973
- The effect of d-functions on molecular orbital energies for hydrocarbonsChemical Physics Letters, 1972
- Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic MoleculesThe Journal of Chemical Physics, 1972
- Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic MoleculesThe Journal of Chemical Physics, 1971
- Molecular orbital theory of the electronic structure of organic compounds. V. Molecular theory of bond separationJournal of the American Chemical Society, 1970
- Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic OrbitalsThe Journal of Chemical Physics, 1969
- Additivity rules for the estimation of thermochemical propertiesChemical Reviews, 1969
- Heats of formation of C4H6 hydrocarbonsJournal of the American Chemical Society, 1968
- Vibrational Spectrum of CyclopropeneThe Journal of Chemical Physics, 1967
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951