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A new gradient-corrected exchange functional

✍ Scribed by GILL, PETER M. W.

Book ID
125861693
Publisher
Taylor and Francis Group
Year
1996
Tongue
English
Weight
259 KB
Volume
89
Category
Article
ISSN
0026-8976

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πŸ“œ SIMILAR VOLUMES

Comparison shopping for a gradient-corre
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✍ John P. Perdew; Kieron Burke πŸ“‚ Article πŸ“… 1996 πŸ› John Wiley and Sons 🌐 English βš– 839 KB

Gradient corrections to the local spin density (LSD) approximation for the exchangecorrelation energy are making density functional theory as useful in quantum chemistry as it is in solid-state physics. But which of the many gradient-corrected density functionals should be preferred a priori? We mak