Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) pdf epub mobi txt 电子书下载 2024

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Robert G. Parr

Oxford University Press, USA

1994-05-26

342

USD 147.95

Paperback

9780195092769

图书标签: DFT 量子化学物理物理学我想读 QC

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发表于2024-11-09

Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) epub 下载 mobi 下载 pdf 下载 txt 电子书下载 2024

Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) pdf epub mobi txt 电子书下载 2024

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This book is a rigorous, unified account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. Containing a detailed discussion of the chemical potential and its derivatives, it provides an understanding of the concepts of electronegativity, hardness and softness, and chemical reactivity. Both the Hohenberg-Kohn-Sham and the Levy-Lieb derivations of the basic theorems are presented, and extensive references to the literature are included. Two introductory chapters and several appendices provide all the background material necessary beyond a knowledge of elementary quantum theory. The book is intended for physicists, chemists, and advanced students in chemistry.

Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) 下载 mobi epub pdf txt 电子书

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Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) pdf epub mobi txt 电子书下载

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这本书的 appendix A 应该撕下来单独卖给刚学分析力学/刚学经典场论的人读。分析力学做变分的时候常常有人直接把泛函微分当偏导看，这进行到场论会导致一大堆错误理解，又因为在场论大家都用拉氏密度不用拉氏量，许多至关重要的细节都被蒙混过去了，比如在场的欧拉拉格朗日方程中时间全导算符应该对全空间的场都做 chain rule 之类细节。

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It has a very useful appendix!

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