Ab initio calculation of the ground state of carbon trioxide in D3h symmetry and the E′ distortion to C2v symmetry
- 1 July 1987
- journal article
- Published by Elsevier in Journal of Molecular Structure: THEOCHEM
- Vol. 152 (3-4) , 213-229
- https://doi.org/10.1016/0166-1280(87)80062-3
Abstract
No abstract availableKeywords
This publication has 18 references indexed in Scilit:
- The structure of carbon trioxideJournal of Computational Chemistry, 1980
- Some aspects of the potential surface for singlet trimethylenemethaneJournal of the American Chemical Society, 1977
- A configuration interaction treatment of 1E' trimethylenemethaneJournal of the American Chemical Society, 1976
- Configuration interaction calculations for 1E′ trimethylenemethaneThe Journal of Chemical Physics, 1976
- A theoretical study of the structure and properties of carbon trioxideChemical Physics Letters, 1971
- AB initio calculation of the structure of the CO3 moleculeChemical Physics Letters, 1970
- Reaction of O(1D) with CO2 at Low TemperaturesThe Journal of Chemical Physics, 1967
- Carbon Trioxide: Its Production, Infrared Spectrum, and Structure Studied in a Matrix of Solid CO2The Journal of Chemical Physics, 1966
- Some Photochemical Reactions of O3 in the Gas PhaseThe Journal of Chemical Physics, 1962
- 470. The electronic orbitals, shapes, and spectra of polyatomic molecules. Part V. Tetratomic, non-hydride molecules, AB3Journal of the Chemical Society, 1953