The suitability for calculating accurately electron affinities positive or . Ε½. negative of the QCISD T , of the B3LYP density functional, and of similar methods is examined critically, using as examples the B y 3 P, 1 D, and Be y 2 P states discussed w Ε½ .x recently by Bauschlicher Int. J. Quantum
On-site to on-line: Barriers to the use of computers for continuing education
β Scribed by Dr. Edward M. Mamary; Dr. Patricia Charles
- Publisher
- John Wiley and Sons
- Year
- 2000
- Tongue
- English
- Weight
- 50 KB
- Volume
- 20
- Category
- Article
- ISSN
- 0894-1912
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