The United Atom Treatment of H2+
Author:
- 1 May 1953
- journal article
- conference paper
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 21 (5) , 928-929
Abstract
Using first‐order perturbation theory on the united atom, closed expressions are obtained for the energies, and the charges which minimize those energies, of the following states: 1sσ, 2pσ, 2pπ, 3pπ, and 3dδ. Numerical calculations based on these expressions show, for the higher states, quite good agreement with the more exact calculations of Teller and Chakravarty.Keywords
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