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The latest developments in quantum and classical molecular dynamics, related techniques, and their applications to several fields of science and engineering. Molecular simulations include a broad range of methodologies such as Monte Carlo, Brownian dynamics, lattice dynamics, and molecular dynamics (MD).Features of this book:• Presents advances in methodologies, introduces quantum methods and lists new techniques for classical MD• Deals with complex systems: biomolecules, aqueous solutions, ice and clathrates, liquid crystals, polymers• Provides chemical reactions, interfaces, catalysis, surface phenomena and solidsAlthough the book is not formally divided into methods and applications, the chapters are arranged starting with those that discuss new algorithms, methods and techniques, followed by several important applications.
Providing a comprehensive review of the state-of-the-art advanced research in the field, Polymer Physics explores the interrelationships among polymer structure, morphology, and physical and mechanical behavior. Featuring contributions from renowned experts, the book covers the basics of important areas in polymer physics while projecting into the future, making it a valuable resource for students and chemists, chemical engineers, materials scientists, and polymer scientists as well as professionals in related industries.
The purpose of aligning short fibres in a fibre-reinforced material is to improve the mechanical properties of the resulting composite. Aligning the fibres, generally in a preferred direction, allows them to contribute as much as possible to reinforcing the material.Flow induced alignment in composite materials details, in a single volume, the science, processing, applications, characterisation and properties of composite materials reinforced with short fibres that have been orientated in a preferred direction by flows arising during processing. The topics discussed include fibre alignment and materials rheology; processes that can produce fibre alignment in polymeric, liquid crystal polymeric, and metallic composites; materials characterization and mechanical properties; and modelling of processes and materials properties.The technology of fibre-reinforced composites is continually evolving and this book provides timely and much needed information about this important class of engineering materials. The bookis an essential reference work for industry and an indispensable guide for the research worker, advanced student and materials scientist.
An analysis of polymer and composite rheology. This second edition covers flow properties of thermoplastic and thermoset polymers, and general principles and applications of all phases of polymer rheology, with new chapters on the rheology of particulate and fibre composites. It also includes new and expanded detail on polymer blends and emulsions, foams, reacting systems, and flow through porous media as well as composite processing operations.
Presenting a completely new approach to examining how polymers move in non-dilute solution, this book focuses on experimental facts, not theoretical speculations, and concentrates on polymer solutions, not dilute solutions or polymer melts. From centrifugation and solvent dynamics to viscosity and diffusion, experimental measurements and their quantitative representations are the core of the discussion. The book reveals several experiments never before recognized as revealing polymer solution properties. A novel approach to relaxation phenomena accurately describes viscoelasticity and dielectric relaxation and how they depend on polymer size and concentration. Ideal for graduate students and researchers interested in the properties of polymer solutions, the book covers real measurements on practical systems, including the very latest results. Every significant experimental method is presented in considerable detail, giving unprecedented coverage of polymers in solution.
Featuring the work of an international group of scholars, this volume covers the transport properties and Soliton models of Polyacetylene, development and application of the theory of Brownian Motion, the fading of memory during the regression of structural fluctuations, the breakdown of the Kramers Theory as a problem of correct modeling, and more.