Density Functionals, Erin R. Johnson

Автор: Parr, Robert G.;Yang Weitao
Название: Density-functional Theory of Atoms and Molecules
ISBN: 0195092767 ISBN-13(EAN): 9780195092769
Издательство: Oxford Academ
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Описание: Provides an account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. This book contains a discussion of the chemical potential and its derivatives. It is intended for physicists, chemists, and advanced students in chemistry.

Автор: Erin R. Johnson
Название: Density Functionals
ISBN: 331919691X ISBN-13(EAN): 9783319196916
Издательство: Springer
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Цена: 30039.00 р.
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Описание: The series Topics in Current Chemistry presents critical reviews of the present and future trends in modern chemical research.

Автор: Daniel Joubert
Название: Density Functionals: Theory and Applications
ISBN: 3540639373 ISBN-13(EAN): 9783540639374
Издательство: Springer
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Цена: 9794.00 р.
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Описание: Largely written in review style, it will also serve as an excellent overview of recent developments.Nonrelativistic and relativistic approaches are discussed and conventional ground-state as well as polarization density functional and time-dependent density functional formalisms are introduced.

Автор: Daniel Joubert
Название: Density Functionals: Theory and Applications
ISBN: 3642083684 ISBN-13(EAN): 9783642083686
Издательство: Springer
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Автор: R.M. Erdahl; Vedene H. Smith Jr.
Название: Density Matrices and Density Functionals
ISBN: 9401082146 ISBN-13(EAN): 9789401082143
Издательство: Springer
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Цена: 50172.00 р.
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Описание: Proceedings of the A. John Coleman Symposium

Автор: Takao Tsuneda
Название: Density Functional Theory in Quantum Chemistry
ISBN: 4431548246 ISBN-13(EAN): 9784431548249
Издательство: Springer
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Цена: 15672.00 р.
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Описание: This book examines density functional theory based on the foundation of quantum chemistry. Unconventional in approach, it reviews basic concepts, then describes the physical meanings of state-of-the-art exchange-correlation functionals and their corrections.

Автор: Wesolowski Tomasz A.
Название: Recent Progress in Orbital-Free Density Functional Theory
ISBN: 9814436720 ISBN-13(EAN): 9789814436724
Издательство: World Scientific Publishing
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Цена: 22968.00 р.
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Описание: This is a comprehensive overview of state-of-the-art computational methods based on orbital-free formulation of density functional theory completed by the most recent developments concerning the exact properties, approximations, and interpretations of the relevant quantities in density functional theory.The book is a compilation of contributions stemming from a series of workshops which had been taking place since 2002. It not only chronicles many of the latest developments but also summarises some of the more significant ones. The chapters are mainly reviews of sub-domains but also include original research.

Автор: Meng Jie
Название: Relativistic Density Functional For Nuclear Structure
ISBN: 9814733253 ISBN-13(EAN): 9789814733250
Издательство: World Scientific Publishing
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Цена: 35640.00 р.
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Описание:

This book aims to provide a detailed introduction to the state-of-the-art covariant density functional theory, which follows the Lorentz invariance from the very beginning and is able to describe nuclear many-body quantum systems microscopically and self-consistently. Covariant density functional theory was introduced in nuclear physics in the 1970s and has since been developed and used to describe the diversity of nuclear properties and phenomena with great success.

In order to provide an advanced and updated textbook of covariant density functional theory for graduate students and nuclear physics researchers, this book summarizes the enormous amount of material that has accumulated in the field of covariant density functional theory over the last few decades as well as the latest developments in this area. Moreover, the book contains enough details for readers to follow the formalism and theoretical results, and provides exhaustive references to explore the research literature.

Автор: Jan K. Labanowski; Jan W. Andzelm
Название: Density Functional Methods in Chemistry
ISBN: 1461278090 ISBN-13(EAN): 9781461278092
Издательство: Springer
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Цена: 14365.00 р.
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Описание: Even the simplest approximation of DF, the local spin density method (LSD), yields molecular structures typical of ab initio correlated methods. However, DF`s greatest advantage is that it can be applied to much larger systems than those approachable by tradition- al ab initio methods, especially when compared with correlated ab initio methods.

Автор: Giustino Feliciano
Название: Materials Modelling Using Density Functional Theory
ISBN: 0199662444 ISBN-13(EAN): 9780199662449
Издательство: Oxford Academ
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Описание: The book explains the fundamental ideas of density functional theory, and how this theory can be used as a powerful method for explaining and even predicting the properties of materials with stunning accuracy.

Автор: E.J. Baerends; R.F. Nalewajski; K. Burke; E. Ernze
Название: Density Functional Theory I
ISBN: 366214834X ISBN-13(EAN): 9783662148341
Издательство: Springer
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Автор: Eugene S. Kryachko; Eduardo V. Lude?a
Название: Energy Density Functional Theory of Many-Electron Systems
ISBN: 9401073813 ISBN-13(EAN): 9789401073813
Издательство: Springer
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