| 查看: 4225 | 回复: 25 | |||
| 【奖励】 本帖被评价20次，作者vegalew增加金币 19.5 个 | |||
[资源]
【分享】新年分享WILEY新书，祝虫友底蕴更上一层楼
|
|||
|
链接：http://www.zshare.net/download/72461692446dead1/ 基本介绍 Density Functional Theory : A Practical Introduction David Sholl, Janice A Steckel ISBN: 978-0-470-37317-0 Hardcover 238 pages April 2009 Wiley List Price: US $99.95 This price is valid for China. Change location to view local pricing and availability. 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. |
回复此楼» 收录本帖的淘帖专辑推荐
 模拟计算 |
» 猜你喜欢
澳门大学IAPME李海峰教授常年招收博士研究生
已经有0人回复
-
澳门大学IAPME李海峰教授常年招收博士研究生
已经有0人回复
-
物理学I论文润色/翻译怎么收费?
已经有229人回复
-
深圳大学应用技术学院招聘凝聚态物理博士后
已经有121人回复
-
求助中医院临床中医中标的青年标书学习，谢谢
已经有5人回复
-
浙大物院表面物理课题组长期招收普博及直博学生
已经有259人回复
-
【征稿】Springer Nature热电专题 Discover Materials / Discover Chemistry
已经有47人回复
-
25届硕士申请，材料计算方向
已经有2人回复
-
课题组招1-2名硕士
已经有1人回复
-
机时越来越贵之后，我把一部分 DFT 流程搬到了 AI 计算平台上
已经有0人回复
2楼2010-02-13 09:54:41
3楼2010-02-15 17:21:19
4楼2010-02-16 11:12:25
5楼2010-02-16 15:48:53
6楼2010-02-23 22:23:34
7楼2010-03-04 16:45:39
8楼2010-03-05 21:51:03
10楼2010-03-11 21:37:17
11楼2010-03-13 00:09:04
12楼2010-03-18 12:06:16
14楼2010-03-21 02:20:31
15楼2010-03-22 10:39:31
18楼2010-03-29 12:14:57
19楼2010-04-03 10:10:50
20楼2010-04-05 13:07:35
21楼2010-05-07 23:33:08
22楼2010-05-09 15:11:32
23楼2010-07-01 10:33:32
24楼2010-08-26 13:19:46
25楼2010-11-27 19:13:56
简单回复
lanheise9楼
2010-03-08 20:23
回复
quantumor13楼
2010-03-18 14:33
回复
顶一下
cadick16楼
2010-03-24 17:41
回复
sqxsg17楼
2010-03-25 06:58
回复
z5476t450826楼
2010-11-30 16:33
回复
