Generalized-exchange local-spin-density-functional theory: Calculations and results for non-self-interaction-corrected and self-interaction-corrected theories
Journal Article
·
· Phys. Rev. A; (United States)
Results of calculations using the non-self-interaction-corrected and self-interaction-corrected generalized-exchange local-spin-density-functional theories are reported and compared to other local-exchange theories. The generalized-exchange theories give most consistent results.
- Research Organization:
- Theoretical Chemistry Group, Chemistry Department, McGill University, 801 Sherbrooke Street West, Montreal, Quebec, Canada H3A2K6
- OSTI ID:
- 6765008
- Journal Information:
- Phys. Rev. A; (United States), Vol. 38:7
- Country of Publication:
- United States
- Language:
- English
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