Density Functional Theory I: Functionals and Effective Potentials: 180 - Rilegato

 
9783540610915: Density Functional Theory I: Functionals and Effective Potentials: 180

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This volume discusses a variety of topics in the field of density functional theory, including where density functionals come from and why they work, nonlocal energy functionals, and exchange and correlation in density functional theory of atoms and molecules.

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Contenuti

Density functionals: Where do they come from, why do they work?.- Nonlocal energy functions: Gradient expansions and beyond.- Exchange and correlation in density functional theory of atoms and molecules.- Analysis and modelling of atomic and molecular kohn-sham potentials.- Local-scaling transformation version of density functional theory: Generation of density functionals.

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