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

 
9783662148341: Density Functional Theory I: Functionals and Effective Potentials: 180

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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