The structure of linear SiCC: An ab initio SCF CI study including vibrational effects
- 28 December 1984
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 112 (6) , 519-523
- https://doi.org/10.1016/0009-2614(84)85769-3
Abstract
No abstract availableThis publication has 22 references indexed in Scilit:
- Visible spectroscopy of jet-cooled SiC2: Geometry and electronic structureThe Journal of Chemical Physics, 1984
- An energetically low-lying silacyclopropyne isomer of SiC2The Journal of Chemical Physics, 1984
- The quantum mechanical calculation of rotational spectra. A comparison of methods for C2H2, HCN, HNC, HCO+, N2H+, CO, and N2. Predictions for HCNH+, COH+, HBO, HBNH, and HBF+The Journal of Chemical Physics, 1984
- Quantum astrochemistry : Prospects and examplesJournal of Molecular Structure: THEOCHEM, 1984
- Theoretical study of silicon dicarbideThe Astrophysical Journal, 1983
- A b i n i t i o calculation of infrared intensities for the linear isoelectronic series HCN, HNC, CO, HCO+, and HOC+The Journal of Chemical Physics, 1982
- The rotational spectra of HCNH/+/ and COH/+/ from quantum mechanical calculationsThe Astrophysical Journal, 1982
- HOC+: An observable interstellar species? A comparison with the isomeric and isoelectronic HCO+, HCN and HNCChemical Physics, 1981
- Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18The Journal of Chemical Physics, 1980
- Efficient determination and characterization of transition states using ab-initio methodsChemical Physics Letters, 1977