Three-Dimensional FE-MO Model. I. ΔH of Dissociation of Homonuclear Diatomic Molecules
- 1 April 1961
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 34 (4) , 1187-1190
- https://doi.org/10.1063/1.1731719
Abstract
By means of a three‐dimensional FE—MO model, the ΔH's of dissociation for homonuclear diatomic molecules can be estimated. The atoms are represented by cubes, and the molecules by rectangular parallepipeds. The parameters involved are the sizes of the boxes and the effective mass of the electrons. The spectroscopic terms for the ground states of both the atoms and the molecules are obtained from the model.Keywords
This publication has 3 references indexed in Scilit:
- Ground State of the C2 MoleculeThe Journal of Chemical Physics, 1959
- THE SPECTRUM OF THE Si2 MOLECULECanadian Journal of Physics, 1955
- The Box Model and Electron Densities in Conjugated SystemsThe Journal of Chemical Physics, 1954