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Jastrow correlation factor for atoms, molecules, and solids

✍ Scribed by Drummond, N. D.; Towler, M. D.; Needs, R. J.

Book ID
127364189
Publisher
The American Physical Society
Year
2004
Tongue
English
Weight
112 KB
Volume
70
Category
Article
ISSN
1098-0121

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Atoms, molecules, solids, and surfaces:
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
✍ Perdew, John P.; Chevary, J. A.; Vosko, S. H.; Jackson, Koblar A.; Pederson, Mar πŸ“‚ Article πŸ“… 1992 πŸ› The American Physical Society 🌐 English βš– 783 KB

Generalized gradient approximations (GGA s) seek to improve upon the accuracy of the local-spin- density (LSD) approximation in electronic-structure calculations. Perdew and Wang have developed a GGA based on real-space cutoff of the spurious long-range components of the second-order gradient ex- pa