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Ellipsoidal representation of the topographical potential and its vertical gradient

✍ Scribed by P. Novák; E. W. Grafarend


Publisher
Springer-Verlag
Year
2005
Tongue
English
Weight
592 KB
Volume
78
Category
Article
ISSN
1432-1394

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Structure of the optimized effective Koh
✍ Oleg Gritsenko; Robert van Leeuwen; Evert Jan Baerends 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 880 KB

An analysis of the structure of the optimized effective Kohr-Sham exchange potential v, and its gradient approximations is presented. The potential is decomposed into the Slater potential us and the response of us to density variations, vresp. The latter exhibits peaks that reflect the atomic shell