Size-Consistency, Self-Interaction Correction, and Derivative Discontinuity in Density Functional Theory
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Elsevier
Reference109 articles.
1. Inhomogeneous Electron Gas
2. Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v-representability problem
3. The density functional formalism, its applications and prospects
4. Density Functional Theory of Atoms and Molecules;Parr,1989
5. The Self Consistent Field For Molecules and Solids;Slater,1974
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