This book details the necessary numerical methods, the theoretical background and foundations and the techniques involved in creating computer particle models,

First time paperback of successful physics monograph. Copyright © Libri GmbH. All rights reserved.

Understanding Molecular Simulation: From Algorithms to Applications explains the physics behind the "recipes" of molecular simulation for materials science. Com

The behaviour of many complex materials extends over time- and lengthscales well beyond those that can normally be described using standard molecular dynamics o

This book focuses on current applications of molecular quantum dynamics. Examples from all main subjects in the field, presented by the internationally renowned