Atomistic Modeling of Physical Properties

By Lucien Monnerie

Book Overview

Contents: - Prediction of Polymer Crystal Structures and Properties - Atomistic Dynamics of Macromolecular Crystals - Brownian Dynamics Simulations of Local Polymer Dynamics - MD Simulation Study of Glass Transition and Short Time Dynamics in Polymer Liquids - Effect of Molecular Structure on Local Chain Dynamics: Analytical Approaches and Computational Methods - Dynamics of Small Molecules in Bulk Polymers - Atomistic Monte Carlo Simulation and Continuum Mean Field Theory of the Structure and Equation of State Properties of Alkane and Polymer Melts - A Critical Evaluation of Novel Algorithms for the Off- Lattice Monte Carlo Simulation of Condensed Polymer Phases - Prism Theory of the Structure, Thermodynamcis, and Phase Transitions of Polymer Liquids and Alloys.

• Format: Hardcover
• Language: English
• ISBN: 3540578277
• ISBN13: 9783540578277
• Release Date: July 1994
• Publisher: Springer
• Length: 389 Pages