Jump to main content
Jump to site search

All chapters
Previous chapter Next chapter

Chapter 2

Introduction to Quantum Behaviour – A Primer

There are many computational procedures available to calculate atomistic systems ranging from ab initio methods, whereby a system is calculated from scratch, i.e. without prior knowledge of the chemical system, to (semi)empirical methods that include experimentally derived parameters (e.g. bond stre...
Print publication date: 27 Mar 2009
Copyright year: 2009
Print ISBN: 978-0-85404-122-0
PDF eISBN: 978-1-84755-997-5
From the book series:
RSC Biomolecular Sciences