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Density functional in locally linear potential approximation

✍ Scribed by R. Baltin


Publisher
Elsevier Science
Year
1971
Tongue
English
Weight
106 KB
Volume
37
Category
Article
ISSN
0375-9601

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Description of core excitations by time-
✍ Yutaka Imamura; Takao Otsuka; Hiromi Nakai πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 143 KB πŸ‘ 1 views

## Abstract Time‐dependent density functional theory (TDDFT) is employed to investigate exchange‐correlation‐functional dependence of the vertical core‐excitation energies of several molecules including H, C, N, O, and F atoms. For the local density approximation (LDA), generalized gradient approxi