Modified bielectronic potential method for correlation energy
β Scribed by Jean-Louis Ruelle
- Publisher
- John Wiley and Sons
- Year
- 1979
- Tongue
- English
- Weight
- 735 KB
- Volume
- 15
- Category
- Article
- ISSN
- 0020-7608
No coin nor oath required. For personal study only.
β¦ Synopsis
Abstract
LΓΆwdin's correlation potential formalism has been used to define a modified bielectronic potential, allowing one to calculate the exact electronic energy, given the HartreeβFock wave function. This modified potential is in principle peculiar to each electronic system, and is defined by a correlation factor depending on the interelectronic distance r~2~. The explicit calculation of the correlation factor has been performed for some twoβelectron atoms, in the 1^1^S and 2^3^S states, and for the beryllium atom. Examination of the results so obtained leads us to conclude in favor of the nonexistence of a universal modified bielectronic potential.
π SIMILAR VOLUMES
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