Density Functional Theory pdf epub mobi txt 電子書下載 2024

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David Sholl

Wiley-Interscience

2009-04-13

252

USD 99.95

Hardcover

9780470373170

圖書標籤: DFT 計算物理物理量子物理新手入門科學電子科學理論化學

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发表于2024-06-29

Density Functional Theory epub 下載 mobi 下載 pdf 下載 txt 電子書下載 2024

Density Functional Theory pdf epub mobi txt 電子書下載 2024

圖書描述

Demonstrates how anyone in math, science, and engineering can master DFT calculations Density functional theory (DFT) is one of the most frequently used computational tools for studying and predicting the properties of isolated molecules, bulk solids, and material interfaces, including surfaces. Although the theoretical underpinnings of DFT are quite complicated, this book demonstrates that the basic concepts underlying the calculations are simple enough to be understood by anyone with a background in chemistry, physics, engineering, or mathematics. The authors show how the widespread availability of powerful DFT codes makes it possible for students and researchers to apply this important computational technique to a broad range of fundamental and applied problems. Density Functional Theory: A Practical Introduction offers a concise, easy-to-follow introduction to the key concepts and practical applications of DFT, focusing on plane-wave DFT. The authors have many years of experience introducing DFT to students from a variety of backgrounds. The book therefore offers several features that have proven to be helpful in enabling students to master the subject, including: Problem sets in each chapter that give readers the opportunity to test their knowledge by performing their own calculations Worked examples that demonstrate how DFT calculations are used to solve real-world problems Further readings listed in each chapter enabling readers to investigate specific topics in greater depth This text is written at a level suitable for individuals from a variety of scientific, mathematical, and engineering backgrounds. No previous experience working with DFT calculations is needed.

Density Functional Theory 下載 mobi epub pdf txt 電子書

著者簡介

圖書目錄

Density Functional Theory pdf epub mobi txt 電子書下載

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用戶評價

評分☆☆☆☆☆

非常好的密度泛函理論入門書籍（車隻要會開就行，不需要知道怎麼造）

評分☆☆☆☆☆

適閤理論計算的新手，可以幫助大傢很好的入門。英文有點門檻，但語言很淺顯。大傢不要被英語嚇到，堅持讀下來，讀不懂的還可以迴頭復習。書裏將理論計算比作開車，我覺得這個比喻很形象。我們不需要知道汽車怎麼造，隻需要學會控製汽車的基本操作（給汽車加油、遵守交通規則），學會將車開起來就行。理論計算新手們不需要探究軟件源代碼怎麼工作，隻要能用軟件計算即可。推薦搭配中科大李震宇的《電子結構理論與計算》課件，構架好框架，知道一些電子結構計算的概念。

評分☆☆☆☆☆

兩位作者好逗啊，真心不像是教材，寫的太好玩兒瞭。。。就是不知道實用價值怎麼樣，看到後麵再評

評分☆☆☆☆☆

讀到作者說“The longer the acronym, the better the level of theory.” 簡直笑慘瞭。配閤固體物理學食用更佳。