Discovering Chemistry with Natural Bond Orbitals

用内在关联轨道发现化学

物理化学

售   价:
802.00
发货周期:预计3-5周发货
作      者
出  版 社
出版时间
2012年06月28日
装      帧
平装
ISBN
9781118119969
复制
页      码
336
语      种
英文
综合评分
暂无评分
我 要 买
- +
库存 30 本
  • 图书详情
  • 目次
  • 买家须知
  • 书评(0)
  • 权威书评(0)
图书简介
This book is about chemical bonds, their intrinsic energies and the corresponding dissociation energies which are relevant in reactivity problems; it is the first book to detail relatively uncomplicated but physically meaningful approaches to molecular properties, an area important to help understand chemical principles and predict chemical properties.?The primary goal of this book is to enable students to gain proficiency in using the NBO program to re-express complex many-electron wavefunctions in terms of intuitive chemical concepts and orbital imagery, with minimal distractions from underlying mathematical or programming details.?Chapters include: getting started; electrons in atoms; atoms in molecules; hybrids and bonds in molecules; resonance delocalization corrections; steric and electrostatic effects; nuclear and electronic spin effects; coordination and hyperbonding; intermolecular interactions; transition state species and chemical reactions; excited state chemistry.?Problems and exercises are included at the end of every chapter.
馆藏图书馆
Harvard Library
本书暂无推荐
本书暂无推荐
看了又看
  • 上一个
  • 下一个