Self-consistent field calculations of pyridine and mono-substituted benzenes
- 1 January 1967
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 12 (3) , 283-286
- https://doi.org/10.1080/00268976700100361
Abstract
A modification of the Mataga approach to SCF calculations is introduced and applied to pyridine and some mono-substituted benzenes.Keywords
This publication has 5 references indexed in Scilit:
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- An SCF calculation of mono-substituted benzenesMolecular Physics, 1966
- Die Absorptionsspektren einiger aromatischer Phosphine und Phosphinoxyde im nahen UltraviolettMonatshefte für Chemie / Chemical Monthly, 1963
- The electronic spectra of the arylarsinesJournal of Molecular Spectroscopy, 1961
- The π-Electron distribution in Pyridine and the molecular-orbital parameters for nitrogenAustralian Journal of Chemistry, 1957