Double orbital exponent SCF functions for H2O, NH3, CH4
- 1 January 1968
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 10 (5) , 454-457
- https://doi.org/10.1007/bf00528776
Abstract
No abstract availableKeywords
This publication has 9 references indexed in Scilit:
- Simple Basis Set for Molecular Wavefunctions Containing Third-Row AtomsThe Journal of Chemical Physics, 1967
- Gaussian Basis SCF Calculations for OH−, H2O, NH3, and CH4The Journal of Chemical Physics, 1967
- LCAO SCF Computations for AmmoniaThe Journal of Chemical Physics, 1966
- Molecular SCF Calculations on CH4, C2H2, C2H4, C2H6, BH3, B2H6, NH3, and HCNJournal of the American Chemical Society, 1966
- Self-Consistent Group Calculations on Polyatomic Molecules. II. Hybridization and Optimum Orbitals in WaterThe Journal of Chemical Physics, 1965
- Gaussian Wavefunctions for the 10-Electron Systems. III. OH−, H2O, H3O+The Journal of Chemical Physics, 1965
- Self-Consistent Field Calculation of the Ground State of MethaneThe Journal of Chemical Physics, 1964
- Criteria for the Construction of Good Self-Consistent-Field Molecular Orbital Wave Functions, and the Significance of LCAO-MO Population AnalysisThe Journal of Chemical Physics, 1962
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951