## Abstract Localized molecular orbitals (LMOs) derived from exchange maximization with respect to all atom‐centered basis functions in the basis set are shown to generate a good starting electronic field for self‐consistent field calculations on extended systems such as metal clusters, for which w
Algorithms for vector field generation in mass consistent models
✍ Scribed by Ciro Flores; Héctor Juárez; Marco A. Núñez; María Luisa Sandoval
- Publisher
- John Wiley and Sons
- Year
- 2009
- Tongue
- English
- Weight
- 401 KB
- Volume
- 26
- Category
- Article
- ISSN
- 0749-159X
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