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Australian Journal of Chemistry Australian Journal of Chemistry Society
An international journal for chemical science
RESEARCH ARTICLE

Numerical calculations of molecular orbitals

RB Potts and IS Walker

Australian Journal of Chemistry 7(3) 211 - 218
Published: 1954

Abstract

The molecular orbitals of 3,4-benzophenanthrene are determined in order to illustrate in detail the use of the alternant and symmetry properties of a molecule to simplify the numerical calculations.

https://doi.org/10.1071/CH9540211

© CSIRO 1954

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