Molecular two-centre integrals
- 1 March 1962
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 5 (2) , 105-114
- https://doi.org/10.1080/00268976200100111
Abstract
Two-centre overlap integrals are evaluated for any combination of s, p, d, f, g and h orbitals for some low value of the parameter n, from which formulae for any higher value of n can be obtained by simple derivation. The formulae are well suited for desk calculations.Keywords
This publication has 6 references indexed in Scilit:
- Some Two-Center Overlap Integrals with AO's of Principal Quantum Number FourThe Journal of Chemical Physics, 1958
- Integraltafeln zur QuantenchemiePublished by Springer Nature ,1956
- Chemical bonds involving d-orbitals. Part IJournal of the Chemical Society, 1954
- On the Stability of Metallo-Organic CompoundsThe Journal of Chemical Physics, 1953
- The evaluation of integrals occurring in the theory of molecular structure. Parts I & IIPhilosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences, 1951
- Formulas and Numerical Tables for Overlap IntegralsThe Journal of Chemical Physics, 1949