| 查看: 215 | 回复: 0 | |||
| 当前主题已经存档。 | |||
xiaowu759铁杆木虫 (著名写手)
|
[交流]
【资源】新书介绍Computational Chemistry Workbook
|
||
|
这本书看上去很不错，希望不久能得到电子版 http://www.wiley-vch.de/publish/en/books/ISBN978-3-527-32442-2/ Computational Chemistry Workbook Learning Through Examples 1. Edition - September 2009 37.90 Euro 2009. XVI, 234 Pages, Softcover - Textbook - ISBN-10: 3-527-32442-9 ISBN-13: 978-3-527-32442-2 - Wiley-VCH, Weinheim Short description Fills a gap for students learning computational and theoretical chemistry by approaching the theories from a practical perspective. Contains 11 different examples transforming the theories into applications in different fields of chemistry. From the contents INTRODUCTION Basics of Computational Chemistry Aim of this Book How to use this Book Structure of this Book The Chapters The Software MOLECULAR COORDINATES AND SYMMETRY Aim Theoretical Background Demonstration Problems Review and Summary VIBRATIONS OF DIATOMIC MOLECULES: THE HARMONIC APPROXIMATION Aim Theoretical Background Demonstration Problems Review and Summary VIBRATIONS OF DIATOMIC MOLECULES: THE SCHRÖDINGER EQUATION Aim Theoretical Background Demonstration Problems Review and Summary ATOMIC ORBITALS Aim Theoretical Background Demonstration Problems Review and Summary IONISATION POTENTIALS AND ELECTRON AFFINITIES OF ATOMS Aim Theoretical Background Demonstration Problems Review and Summary HÜCKEL MOLECULAR ORBITAL THEORY: STABILITY OF CONJUGATED CARBON PI-SYSTEMS Aim Theoretical Background Demonstration Problems Review and Summary HÜCKEL MOLECULAR ORBITAL THEORY: BOND ORDER, CHARGE ORDER, AND MOLECULAR ORBITALS Aim Theoretical Background Demonstration Problems Review and Summary GEOMETRY OPTIMIZATION OF A DIATOMIC MOLECULE Aim Theoretical Background Demonstration Problems Review and Summary THE ELECTRON SPIN Aim Theoretical Background Demonstration Problems Review and Summary VIBRATIONAL SPECTROSCOPY Aim Theoretical Background Demonstration Problems Review and Summary VIBRATIONAL SPECTROSCOPY AND CHARACTER TABLES - ADVANCED TOPICS Aim Theoretical Background Demonstration Problems Review and Summary IONISATION POTENTIAL AND ELECTRON AFFINITIES OF MOLECULES Aim Theoretical Background Demonstration Problems Review and Summary THERMOCHEMISTRY Aim Theoretical Background Demonstration Problems Review and Summary MOLECULAR DYNAMICS - BASIC CONCEPTS Aim Theoretical Background Demonstration Problems Review and Summary MOLECULAR DYNAMICS AND BASIC THERMODYNAMICS Aim Theoretical Background Demonstration Problems Review and Summary MOLECULAR DYNAMICS - SIMULATED ANNEALING Aim Theoretical Background Demonstration Problems Review and Summary APPENDIX: THE COMPUTATIONAL CHEMISTRY SOFTWARE DELIVERED WITH THIS BOOK Getting Started A Brief Introduction to Linux Character Tables for Chemically Important Point Groups Computational Chemistry Software Delivered with this Book |
回复此楼» 猜你喜欢
阴离子交换膜电解二氧化碳还原
已经有0人回复
-
Chemical Bonding at Surfaces and Interfaces,最经典的一本表面上化学相互作用教材
已经有0人回复
-
物理化学论文润色/翻译怎么收费?
已经有253人回复
-
分子动力学模拟合作需求
已经有2人回复
-
九江学院2026年最新高层次人才招聘公告
已经有0人回复
-
深圳信息职业技术学院2026年教师招聘公告（最新）
已经有0人回复
-
诚邀有志之士加入江苏大学环境学院合成生物学课题组！(长期接收学硕专硕、硕博连读)
已经有16人回复
-
研究生招生
已经有0人回复
-
一志愿南大理论与计算化学方向（070300）342分，求调剂
已经有1人回复
-
欢迎化学、化工、物理、材料、或计算机背景的考研咨询
已经有0人回复
5