Theoretical calculation of the structure and spectra of lithium oxides
- 1 November 1977
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 67 (9) , 4019-4026
- https://doi.org/10.1063/1.435430
Abstract
No abstract availableKeywords
This publication has 38 references indexed in Scilit:
- Simple ab initio studies on the isomers of N2H2, Li2O, C3H4, and O3Journal of the American Chemical Society, 1975
- Hartree-Fock-Roothaan wavefunctions for diatomic moleculesAtomic Data and Nuclear Data Tables, 1975
- Properties of atoms in molecules. V. Easy procedure for estimating atomic charges from calculated core-electron energiesJournal of the American Chemical Society, 1973
- Mixed basis scheme for the rapid computation of molecular electronic energy in the SCF-LCAO-(STO [Slater-type orbitals])-MO formalism, and its application to the lithium superoxide moleculeThe Journal of Physical Chemistry, 1972
- Accurate Potential Curves and Properties for the X 2π and A 2Σ+ States of LiOThe Journal of Chemical Physics, 1972
- A separated‐electron pair study of the electronic structure of the Li2O moleculeInternational Journal of Quantum Chemistry, 1972
- Theoretical Calculation of the Electronic States of the Molecule LiOBulletin des Sociétés Chimiques Belges, 1972
- Geometry of Molecules. III. F2O, Li2O, FOH, LiOHThe Journal of Chemical Physics, 1966
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951
- Zur Theorie der Wechselwirkung zwischen Elektronen- und Kernbewegung bei dreiatomigen, stabf rmigen Molek lenThe European Physical Journal A, 1934