Computer Simulation of Porous Materials:Current Approaches and Future Opportunities

Computer Simulation of Porous Materials:Current Approaches and Future Opportunities (ISSN)
Author:Kim Jelfs
Publisher Finelybook 出版社:Royal Society of Chemistry; 1st edition (September 8, 2021)
Language 语言:English
pages 页数:324 pages
ISBN-10 书号:1788019008
ISBN-13 书号:9781788019002

Book Description
Computer Simulation of Porous Materials covers the key approaches in the modelling of porous materials, with a focus on how these can be used for structure prediction and to either rationalise or predict a range of properties including sorption, diffusion, mechanical, spectroscopic and catalytic. The book covers the full breadth of (micro)porous materials, from inorganic (zeolites), to organic including porous polymers and porous molecular materials, and hybrid materials (metal-organic frameworks). Through chapters focusing on techniques for specific types of applications and properties, the book outlines the challenges and opportunities in applying approaches and methods to different classes of systems, including a discussion of high-throughput screening. There is a strong forward-looking focus, to identify where increased computer power or artificial intelligence techniques such as machine learning have the potential to open up new avenues of research. Edited Author:a world leader in the field, this title provides a valuable resource for not only computational researchers, but also gives an overview for experimental researchers. It is presented at a level accessible to advanced undergraduates, postgraduates and researchers wishing to learn more about the topic


下载地址:

Computer Simulation of Porous Materials 9781788019002.rar (访问密码:142857)

隐藏内容1积分,请先!没有帐号? 注 册 一个!
赞(0) 觉得文章有用就打赏一下
未经允许不得转载:finelybook » Computer Simulation of Porous Materials:Current Approaches and Future Opportunities

评论 下载问题及网盘链接失效反馈!

评论前必须登录!

觉得文章有用就打赏一下

支付宝扫一扫打赏

微信扫一扫打赏