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 Рейтинг: Цена: 58774.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: The series Structure and Bonding publishes critical reviews on topics of research concerned with chemical structure and bonding.
Автор: Mihai V. Putz; D. Michael P. Mingos Название: Applications of Density Functional Theory to Chemical Reactivity ISBN: 3642441769 ISBN-13(EAN): 9783642441769 Издательство: Springer Рейтинг: Цена: 30039.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: The series Structure and Bonding publishes critical reviews on topics of research concerned with chemical structure and bonding.
Автор: Takao Tsuneda Название: Density Functional Theory in Quantum Chemistry ISBN: 4431548246 ISBN-13(EAN): 9784431548249 Издательство: Springer Рейтинг: Цена: 15672.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
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: Jan K. Labanowski; Jan W. Andzelm Название: Density Functional Methods in Chemistry ISBN: 1461278090 ISBN-13(EAN): 9781461278092 Издательство: Springer Рейтинг: Цена: 14365.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
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: Daniel Joubert Название: Density Functionals: Theory and Applications ISBN: 3540639373 ISBN-13(EAN): 9783540639374 Издательство: Springer Рейтинг: Цена: 9794.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
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 Рейтинг: Цена: 9794.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Автор: Wesolowski Tomasz A. Название: Recent Progress in Orbital-Free Density Functional Theory ISBN: 9814436720 ISBN-13(EAN): 9789814436724 Издательство: World Scientific Publishing Рейтинг: Цена: 22968.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
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: D.E. Ellis Название: Density Functional Theory of Molecules, Clusters, and Solids ISBN: 9401042187 ISBN-13(EAN): 9789401042185 Издательство: Springer Рейтинг: Цена: 26122.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties.
Автор: Takao Tsuneda Название: Density Functional Theory in Quantum Chemistry ISBN: 443156344X ISBN-13(EAN): 9784431563440 Издательство: Springer Рейтинг: Цена: 13059.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
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.
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