Accurate ab initio energetics of extended systems via explicit correlation embedded in a density functional environment
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference33 articles.
1. Iterative minimization techniques forab initiototal-energy calculations: molecular dynamics and conjugate gradients
2. Self-interaction correction to density-functional approximations for many-electron systems
3. For example, P. Fulde, Electron Correlations in Molecules and Solids, Springer-Verlag, Berlin, 1995.
4. Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
5. Application of gradient corrections to density-functional theory for atoms and solids
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