Published April 2010
| Version v1
Journal article
Sum rules for the exchange-correlation energy functional of the extended constrained-search theory: Application to checking the validity of the vorticity expansion approximation of the current-density functional theory
Creators
- 1. Graduate School of Advanced Sciences of Matter, Hiroshima University, Higashi-Hiroshima 739-8527 (Japan)
- 2. Department of Physics, Faculty of Science, Shinshu University, Matsumoto 390-8621 (Japan)
Description
We present four kinds of sum rules for the exchange-correlation energy functional of the extended constrained-search theory. They are applicable even to the conventional density functional theory. As an application of these sum rules, we utilize them to check the validity of the vorticity expansion approximation (VEA) of the current-density functional theory (CDFT). The VEA formula fulfils three of them, though the local density approximation formula of the CDFT fulfills only one. The validity of the VEA formula is thus confirmed successfully from the viewpoint of the sum rules.
Additional details
Identifiers
Publishing Information
- Journal Title
- Physical Review. A
- Journal Volume
- 81
- Journal Issue
- 4
- Journal Page Range
- p. 042505-042505.8
- ISSN
- 1050-2947
- CODEN
- PLRAAN
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 42007172
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- APPROXIMATIONS; CURRENT DENSITY; DENSITY FUNCTIONAL METHOD; ELECTRON CORRELATION; SUM RULES
- Descriptors DEC
- CALCULATION METHODS; CORRELATIONS; EQUATIONS; VARIATIONAL METHODS
Optional Information
- Notes
- (c) 2010 The American Physical Society