In this article, we derive the analytical asymptotic structure in the Ž . classically forbidden region of atoms of the Kohn᎐Sham KS theory exchange᎐correlation Ž . KS w x Ž . KS w x potential defined as the functional derivative r s ␦ E r␦ r , where E is xc xc xc Ž . the KS exchange᎐correlation ene
The asymptotic exchange potential in Kohn–Sham theory
✍ Scribed by Tozer, David J.
- Book ID
- 121221543
- Publisher
- American Institute of Physics
- Year
- 2000
- Tongue
- English
- Weight
- 364 KB
- Volume
- 112
- Category
- Article
- ISSN
- 0021-9606
- DOI
- 10.1063/1.480505
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