An LCAO-MO-SCF calculation on the cyanide ion (CN−) with a double-zeta basis set of Slater functions
- 1 August 1970
- journal article
- research article
- Published by Elsevier in Journal of Molecular Structure
- Vol. 6 (2) , 155-157
- https://doi.org/10.1016/0022-2860(70)87009-0
Abstract
No abstract availableThis publication has 5 references indexed in Scilit:
- Study of Electronic Structure of Molecules. IX. Remarks on the Cyano GroupThe Journal of Chemical Physics, 1969
- Theoretical Study on the Proton Affinity of Small Molecules Using Gaussian Basis Sets in the LCAO–MO–SCF FrameworkThe Journal of Chemical Physics, 1968
- Physical nature of the chemical bond II. Valence atomic orbital and energy partitioning studies of linear nitrilesInternational Journal of Quantum Chemistry, 1968
- Computation of Molecular Properties and StructureIBM Journal of Research and Development, 1968
- SCF Minimal Basis Set Calculations and Exclusive Orbitals for CN−, HCN, N3−, HN3, NCO−, and HNCOThe Journal of Chemical Physics, 1968