Please note: In order to keep Hive up to date and provide users with the best features, we are no longer able to fully support Internet Explorer. The site is still available to you, however some sections of the site may appear broken. We would encourage you to move to a more modern browser like Firefox, Edge or Chrome in order to experience the site fully.

Supporting your high street Find out how »
Valence Bond Methods : Theory and Applications, PDF eBook

Valence Bond Methods : Theory and Applications PDF

PDF

Download - Immediately Available
Please note: eBooks can only be purchased with a UK issued credit card and all our eBooks (ePub and PDF) are DRM protected.

Description

Valence bond theory is one of two commonly used methods in molecular quantum mechanics, the other is molecular orbital theory.

This book focuses on the first of these methods, ab initio valence bond theory.

The book is split into two parts. Part I gives simple examples of two-electron calculations and the necessary theory to extend these to larger systems.

Part II gives a set of case studies of related molecule sets designed to show the nature of the valence bond description of molecular structure.

It also highlights the stability of this description to varying basis sets.

There are references to the CRUNCH computer program for molecular structure calculations which is currently available in the public domain.

The book will be of primary interest to researchers and students working on electronic theory and computation in chemistry and chemical physics.

Information

Save 15%

£36.99

£31.44

Download - Immediately Available
Add to Basket
Sign in to add to wishlist
 
Delivered to your inbox

to transfer to your device

eBook Help

Is this the right eBook for
my device? How do I download
this eBook? See help and FAQs pages

Information