Computational Methods in Polymer Science
Author | : Doi |
Publisher | : Academic Press |
Total Pages | : 350 |
Release | : 1999-12 |
Genre | : |
ISBN | : 9780122197703 |
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Author | : Doi |
Publisher | : Academic Press |
Total Pages | : 350 |
Release | : 1999-12 |
Genre | : |
ISBN | : 9780122197703 |
Author | : Elizabeth A. Colbourn |
Publisher | : Longman Publishing Group |
Total Pages | : 360 |
Release | : 1994 |
Genre | : Science |
ISBN | : |
For chemists, physicists, and students of computer simulation, provides a detailed examination of the complex problems of time and size scaling in molecular modeling and simulation. It includes not only atomistic modeling but also coarse-grained models, which allow longer time scales and therefore larger systems to be studied. Monte Carlo methods are also discussed, and have proven to be particularly powerful tools for examining a range of polymer problems. Assumes a background knowledge of synthetic polymer properties and simulation. Annotation copyright by Book News, Inc., Portland, OR
Author | : Masoud Soroush |
Publisher | : MDPI |
Total Pages | : 320 |
Release | : 2020-12-10 |
Genre | : Technology & Engineering |
ISBN | : 303928813X |
This book presents recent advances in computational methods for polymers. It covers multiscale modeling of polymers, polymerization reactions, and polymerization processes as well as control, monitoring, and estimation methods applied to polymerization processes. It presents theoretical insights gained from multiscale modeling validated with exprimental measurements. The book consolidates new computational tools and methods developed by academic researchers in this area and presents them systematically. The book is useful for graduate students, researchers, and process engineers and managers.
Author | : Kurt Binder |
Publisher | : Oxford University Press |
Total Pages | : 602 |
Release | : 1995-08-03 |
Genre | : Science |
ISBN | : 0195357469 |
Written by leading experts from around the world, Monte Carlo and Molecular Dynamics Simulations in Polymer Science comprehensively reviews the latest simulation techniques for macromolecular materials. Focusing in particular on numerous new techniques, the book offers authoritative introductions to solutions of neutral polymers and polyelectrolytes; dynamics of polymer melts, rubbers and gels, and glassy materials; thermodynamics of polymer mixing and mesophase formation, and polymers confined at interfaces and grafted to walls. Throughout, contributors offer practical advice on how to overcome the unique challenges posed by the large size and slow relaxation of polymer coils. Students and researchers in polymer chemistry, polymer physics, chemical engineering, and materials and computational science will all benefit from the cogent, step-by-step introductions contained in this important new book.
Author | : Purushottam D. Gujrati |
Publisher | : John Wiley & Sons |
Total Pages | : 564 |
Release | : 2010-03-30 |
Genre | : Technology & Engineering |
ISBN | : 9783527630264 |
Filling a gap in the literature and all set to become the standard in this field, this monograph begins with a look at computational viscoelastic fluid mechanics and studies of turbulent flows of dilute polymer solutions. It then goes on discuss simulations of nanocomposites, polymerization kinetics, computational approaches for polymers and modeling polyelectrolytes. Further sections deal with tire optimization, irreversible phenomena in polymers, the hydrodynamics of artificial and bacterial flagella as well as modeling and simulation in liquid crystals. The result is invaluable reading for polymer and theoretical chemists, chemists in industry, materials scientists and plastics technologists.
Author | : Yukihiro Ozaki |
Publisher | : John Wiley & Sons |
Total Pages | : 500 |
Release | : 2021-10-29 |
Genre | : Science |
ISBN | : 3527830324 |
An insightful exploration of cutting-edge spectroscopic techniques in polymer characterization In Spectroscopic Techniques for Polymer Characterization: Methods, Instrumentation, Applications, a team of distinguished chemists delivers a comprehensive exploration of the vast potential of spectroscopic characterization techniques in polymer research. The book offers a concise outline of the principles, advantages, instrumentation, experimental techniques, and noteworthy applications of cutting-edge spectroscopy. Covering a wide range of polymers, from nylon to complex polymeric nanocomposites, the author presents recent developments in polymer science to polymer, analytical, and material chemists, assisting them in keeping track of the progress in modern spectroscopy. Spectroscopic Techniques for Polymer Characterization contains contributions from pioneers in modern spectroscopic techniques from around the world. The included materials bridge the gap between spectroscopists, polymer scientists, and engineers in academia and industry. The book also offers: A thorough introduction to the progress in spectroscopic techniques, including polymer spectroscopy and near-infrared spectroscopy Comprehensive explorations of topical polymers studied by spectroscopy, including polymer thin films, fluoropolymers, polymer solutions, conductive polymers Practical discussions of infrared imaging, near-infrared imaging, two-dimensional correlation spectroscopy, and far-ultraviolet spectroscopy In-depth examinations of spectroscopic studies of weak hydrogen bonding in polymers Spectroscopic Techniques for Polymer Characterization: Methods, Instrumentation, Applications is a must-read reference for polymer, analytical, and physical chemists, as well as materials scientists and spectroscopists seeking a one-stop resource for polymer characterization using spectroscopic analyses.
Author | : Malgorzata Borowko |
Publisher | : CRC Press |
Total Pages | : 958 |
Release | : 2019-04-23 |
Genre | : Science |
ISBN | : 1420030035 |
This volume presents computer simulation methods and mathematical modelling of physical processes used in surface science research. It offers in-depth analysis of advanced theoretical approaches to behaviours of fluids in contact with porous, semiporous and nonporous solid surfaces. The book also explores interfacial systems for a wide variety of p
Author | : Mariam Al Ali AlMaadeed |
Publisher | : Elsevier |
Total Pages | : 674 |
Release | : 2020-05-29 |
Genre | : Technology & Engineering |
ISBN | : 0128173033 |
Polymer Science and Innovative Applications: Materials, Techniques, and Future Developments introduces the science of innovative polymers and composites, their analysis via experimental techniques and simulation, and their utilization in a variety of application areas. This approach helps to unlock the potential of new materials for product design and other uses. The book also examines the role that these applications play in the human world, from pollution and health impacts, to their potential to make a positive contribution in areas including environmental remediation, medicine and healthcare, and renewable energy. Advantages, disadvantages, possibilities, and challenges relating to the utilization of polymers in human society are included. - Presents the latest advanced applications of polymers and their composites and identifies key areas for future development - Introduces the simulation methods and experimental techniques involved in the modification of polymer properties, supported by clear and detailed images and diagrams - Supports an interdisciplinary approach, enabling readers across different fields to harness the power of new materials for innovative applications
Author | : Kaoru Ohno |
Publisher | : Springer Science & Business Media |
Total Pages | : 342 |
Release | : 1999-08-18 |
Genre | : Science |
ISBN | : 9783540639619 |
Powerful computers now enable scientists to model the physical and chemical properties and behavior of complex materials using first principles. This book introduces dramatically new computational techniques in materials research, specifically for understanding molecular dynamics.
Author | : Vassilios Galiatsatos |
Publisher | : John Wiley & Sons |
Total Pages | : 325 |
Release | : 2005-02-03 |
Genre | : Science |
ISBN | : 0471464813 |
Among the thousands of synthesized polymers, new polymeric substances and materials with new, often unusual, properties often arise. Consequently, this presents a problem in determining the physical properties of polymers, and thus makes it difficult to ascertain how to synthesize polymers with desired properties. This book discusses what molecular modelling can do to predict the properties of realistic polymer systems. Organized by property, each chapter will address the methods one may use to study the particular system. * Focuses on polymer properties rather than methods, making it more accessible to the average scientist/engineer * All important polymers will be covered, such as amorphous polymers, semicrystalline polymers, elastomers, emulsions, polymer interfaces and surfaces * Chapters contributed by experts in the field * Discusses current commercial software used in molecular simulation