Electronic Structure Methods for Complex Materials 在线电子书 pdf 下载 txt下载 epub 下载 mobi 下载 2024

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Wai-Yim Ching 作者

Oxford University Press, USA

译者

2012-7-22 出版日期

360 页数

USD 117.00 价格

Hardcover

丛书系列

9780199575800 图书编码

Electronic Structure Methods for Complex Materials 在线电子书图书标签: 电子结构计算方法

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Electronic Structure Methods for Complex Materials 在线电子书 epub 下载 mobi 下载 pdf 下载 txt 下载 2024

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Electronic Structure Methods for Complex Materials 在线电子书 pdf 下载 txt下载 epub 下载 mobi 在线电子书下载

Electronic Structure Methods for Complex Materials 在线电子书图书描述

Density functional theory (DFT) has blossomed in the past few decades into a powerful tool that is used by experimentalists and theoreticians alike. This book highlights the extensive contributions that the DFT-based OLCAO method has made to progress in this field, and it demonstrates its competitiveness for performing ab initio calculations on large and complex models of practical systems. A brief historical account and introduction to the elements of the theory set the stage for discussions on semiconductors, insulators, crystalline metals and alloys, complex crystals, non-crystalline solids and liquids, microstructure containing systems and those containing impurities, defects, and surfaces, biomolecular systems, and the technique of ab initio core level spectroscopy calculation.

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