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A Primer in Density Functional Theory
ISBN-13:
9783540370727
Veröffentl:
2008
Seiten:
258
Autor:
Carlos Fiolhais
Serie:
620, Lecture Notes in Physics
eBook Typ:
PDF
eBook Format:
EPUB
Kopierschutz:
1 - PDF Watermark
Sprache:
Englisch
Beschreibung:
Density functional theory (DFT) is by now a well-established method for tackling the quantum mechanics of many-body systems. Originally applied to compute properties of atoms and simple molecules, DFT has quickly become a work horse for more complex applications in the chemical and materials sciences. The present set of lectures, spanning the whole range from basic principles to relativistic and time-dependent extensions of the theory, is the ideal introduction for graduate students or nonspecialist researchers wishing to familiarize themselves with both the basic and most advanced techniques in this field.
Density Functionals for Non-relativistic Coulomb Systems in the New Century.- Orbital-Dependent Functionals for the Exchange-Correlation Energy: A Third Generation of Density Functionals.- Relativistic Density Functional Theory.- Time-Dependent Density Functional Theory.- Density Functional Theories and Self-energy Approaches.- A Tutorial on Density Functional Theory.
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