Clusters of hydrogen molecules: Ab initio SCF calculations corrected semiempirically for correlation energies
- 1 March 1979
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 53 (1) , 1-7
- https://doi.org/10.1007/bf00547603
Abstract
No abstract availableKeywords
This publication has 14 references indexed in Scilit:
- Chiroptical properties of 1-(2-,3-,4-pyridyl)ethanolsCollection of Czechoslovak Chemical Communications, 1978
- Molecular orbital studies of methanol polymers using a minimal basis setThe Journal of Chemical Physics, 1977
- An ab initio investigation of (formamide)n and formamide-(water)n systems. Tentative models for the liquid state and dilute aqueous solutionJournal of the American Chemical Society, 1976
- Semiempirical estimates of the correlation energy in small clusters of hydrogen atomsTheoretical Chemistry Accounts, 1975
- Weak intermolecular interactionTheoretical Chemistry Accounts, 1975
- Weak intermolecular interactionTheoretical Chemistry Accounts, 1975
- Study of the structure of molecular complexes. VI. Dimers and small clusters of water molecules in the Hartree-Fock approximationThe Journal of Chemical Physics, 1974
- Estimation of binding energies of molecules by a semiempirical molecular orbital electron correlation method with applications to saturated and unsaturated hydrocarbons, aromatics, and heterocyclicsJournal of the American Chemical Society, 1973
- Semi-empirical effective pair correlation parameters and correlation energies of BH, CH, NH, OH, HF, N2, and CH4Theoretical Chemistry Accounts, 1972
- Theory of Molecular Interactions. I. Molecular Orbital Studies of Water Polymers Using a Minimal Slater-Type BasisThe Journal of Chemical Physics, 1970