书目名称 | Variational Methods in Molecular Modeling | 编辑 | Jianzhong Wu | 视频video | | 概述 | Provides a unified approach to understanding and quantitative prediction of the properties and rich behavior of diverse many-body systems.Offers a balanced mix of physical intuition, mathematical deri | 丛书名称 | Molecular Modeling and Simulation | 图书封面 |  | 描述 | This book presents tutorial overviews for many applications of variational methods to molecular modeling. Topics discussed include the Gibbs-Bogoliubov-Feynman variational principle, square-gradient models, classical density functional theories, self-consistent-field theories, phase-field methods, Ginzburg-Landau and Helfrich-type phenomenological models, dynamical density functional theory, and variational Monte Carlo methods. Illustrative examples are given to facilitate understanding of the basic concepts and quantitative prediction of the properties and rich behavior of diverse many-body systems ranging from inhomogeneous fluids, electrolytes and ionic liquids in micropores, colloidal dispersions, liquid crystals, polymer blends, lipid membranes, microemulsions, magnetic materials and high-temperature superconductors. .All chapters are written by leading experts in the field and illustrated with tutorial examples for their practical applications to specific subjects. With emphasis placed on physical understanding rather than on rigorous mathematical derivations, the content is accessible to graduate students and researchers in the broad areas of materials science and engineerin | 出版日期 | Book 2017 | 关键词 | Classical DFT; Field Theories; Inhomogeneous Fluids; Phase Transitions; Statistical Mechanics; Thermodyna | 版次 | 1 | doi | https://doi.org/10.1007/978-981-10-2502-0 | isbn_softcover | 978-981-10-9632-7 | isbn_ebook | 978-981-10-2502-0Series ISSN 2364-5083 Series E-ISSN 2364-5091 | issn_series | 2364-5083 | copyright | The Editor(s) (if applicable) and The Author(s), under exclusive license to Springer Nature Singapor |
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