Numerical Methods for Polymeric Systems

Numerical Methods for Polymeric Systems PDF Author: Stuart G. Whittington
Publisher: Springer Science & Business Media
ISBN: 1461217040
Category : Mathematics
Languages : en
Pages : 225

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Book Description
Polymers occur in many different states and their physical properties are strongly correlated with their conformations. The theoretical investigation of the conformational properties of polymers is a difficult task and numerical methods play an important role in this field. This book contains contributions from a workshop on numerical methods for polymeric systems, held at the IMA in May 1996, which brought together chemists, physicists, mathematicians, computer scientists and statisticians with a common interest in numerical methods. The two major approaches used in the field are molecular dynamics and Monte Carlo methods, and the book includes reviews of both approaches as well as applications to particular polymeric systems. The molecular dynamics approach solves the Newtonian equations of motion of the polymer, giving direct information about the polymer dynamics as well as about static properties. The Monte Carlo approaches discussed in this book all involve sampling along a Markov chain defined on the configuration space of the system. An important feature of the book is the treatment of Monte Carlo methods, including umbrella sampling and multiple Markov chain methods, which are useful for strongly interacting systems such as polymers at low temperatures and in compact phases. The book is of interest to workers in polymer statistical mechanics and also to a wider audience interested in numerical methods and their application in polymeric systems.

Numerical Methods for Polymeric Systems

Numerical Methods for Polymeric Systems PDF Author: Stuart G. Whittington
Publisher: Springer Science & Business Media
ISBN: 1461217040
Category : Mathematics
Languages : en
Pages : 225

Get Book Here

Book Description
Polymers occur in many different states and their physical properties are strongly correlated with their conformations. The theoretical investigation of the conformational properties of polymers is a difficult task and numerical methods play an important role in this field. This book contains contributions from a workshop on numerical methods for polymeric systems, held at the IMA in May 1996, which brought together chemists, physicists, mathematicians, computer scientists and statisticians with a common interest in numerical methods. The two major approaches used in the field are molecular dynamics and Monte Carlo methods, and the book includes reviews of both approaches as well as applications to particular polymeric systems. The molecular dynamics approach solves the Newtonian equations of motion of the polymer, giving direct information about the polymer dynamics as well as about static properties. The Monte Carlo approaches discussed in this book all involve sampling along a Markov chain defined on the configuration space of the system. An important feature of the book is the treatment of Monte Carlo methods, including umbrella sampling and multiple Markov chain methods, which are useful for strongly interacting systems such as polymers at low temperatures and in compact phases. The book is of interest to workers in polymer statistical mechanics and also to a wider audience interested in numerical methods and their application in polymeric systems.

The Equilibrium Theory of Inhomogeneous Polymers

The Equilibrium Theory of Inhomogeneous Polymers PDF Author: Glenn Fredrickson
Publisher: Oxford University Press on Demand
ISBN: 0198567294
Category : Science
Languages : en
Pages : 452

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Book Description
This book provides a pedagogical introduction to the theoretical and computer simulation techniques that are useful in the design of polymer formulations including personal care products, multiphase plastic materials, processed foods, and colloidal and nanoparticle dispersions. The book serves to unify previous work in a common language and provides a balanced treatment of analytical theory and numerical techniques, including an introduction to the exciting new field offield-theoretic polymer simulations - the direct numerical simulation of field theory models of meso-structured polymer melts, solutions, and dispersions.

Eco-friendly and Smart Polymer Systems

Eco-friendly and Smart Polymer Systems PDF Author: Hamid Mirzadeh
Publisher: Springer Nature
ISBN: 3030450856
Category : Technology & Engineering
Languages : en
Pages : 747

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Book Description
This proceedings book presents the main findings of the 13th International Seminar on Polymer Science and Technology ( ISPST 2018), which was held at Amirkabir University of Technology, Tehran, on November 10–22, 2018. This forum was the culmination of more than three decades of academic and industrial activities of Iranian scholars and professionals, and the participation of many notable international scientists, in covering various important polymer-related subjects of concern to Iran and the world at large, including polymer synthesis, processing and properties, as well as issues concerning polymer degradation, stability, and environmental aspects. For the past half a century, the growing concern for advancing human health, quality of life, and – especially in the last few decades – avoiding and combating environmental pollution have shaped and driven scientific activities geared toward the creation of smart materials that are compatible with the human body, and have prompted scientists and technologists to pursue research using natural and sustainable sources. This book highlights efforts to responsibly address the problems caused by, and which can potentially be solved by, polymers and plastics.

Properties of Polymers

Properties of Polymers PDF Author: D.W. van Krevelen
Publisher: Elsevier
ISBN: 0444596127
Category : Technology & Engineering
Languages : en
Pages : 898

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Book Description
Properties of Polymers: Their Correlation with Chemical Structure; Their Numerical Estimation and Prediction from Additive Group Contributions summarizes the latest developments regarding polymers, their properties in relation to chemical structure, and methods for estimating and predicting numerical properties from chemical structure. In particular, it examines polymer electrical properties, magnetic properties, and mechanical properties, as well as their crystallization and environmental behavior and failure. The rheological properties of polymer melts and polymer solutions are also considered. Organized into seven parts encompassing 27 chapters, this book begins with an overview of polymer science and engineering, including the typology of polymers and their properties. It then turns to a discussion of thermophysical properties, from transition temperatures to volumetric and calorimetric properties, along with the cohesive aspects and conformation statistics. It also introduces the reader to the behavior of polymers in electromagnetic and mechanical fields of force. The book covers the quantities that influence the transport of heat, momentum, and matter, particularly heat conductivity, viscosity, and diffusivity; properties that control the chemical stability and breakdown of polymers; and polymer properties as an integral concept, with emphasis on processing and product properties. Readers will find tables that give valuable (numerical) data on polymers and include a survey of the group contributions (increments) of almost every additive function considered. This book is a valuable resource for anyone working on practical problems in the field of polymers, including organic chemists, chemical engineers, polymer processers, polymer technologists, and both graduate and PhD students.

Polymer Science: A Comprehensive Reference

Polymer Science: A Comprehensive Reference PDF Author:
Publisher: Newnes
ISBN: 0080878628
Category : Technology & Engineering
Languages : en
Pages : 7752

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Book Description
The progress in polymer science is revealed in the chapters of Polymer Science: A Comprehensive Reference, Ten Volume Set. In Volume 1, this is reflected in the improved understanding of the properties of polymers in solution, in bulk and in confined situations such as in thin films. Volume 2 addresses new characterization techniques, such as high resolution optical microscopy, scanning probe microscopy and other procedures for surface and interface characterization. Volume 3 presents the great progress achieved in precise synthetic polymerization techniques for vinyl monomers to control macromolecular architecture: the development of metallocene and post-metallocene catalysis for olefin polymerization, new ionic polymerization procedures, and atom transfer radical polymerization, nitroxide mediated polymerization, and reversible addition-fragmentation chain transfer systems as the most often used controlled/living radical polymerization methods. Volume 4 is devoted to kinetics, mechanisms and applications of ring opening polymerization of heterocyclic monomers and cycloolefins (ROMP), as well as to various less common polymerization techniques. Polycondensation and non-chain polymerizations, including dendrimer synthesis and various "click" procedures, are covered in Volume 5. Volume 6 focuses on several aspects of controlled macromolecular architectures and soft nano-objects including hybrids and bioconjugates. Many of the achievements would have not been possible without new characterization techniques like AFM that allowed direct imaging of single molecules and nano-objects with a precision available only recently. An entirely new aspect in polymer science is based on the combination of bottom-up methods such as polymer synthesis and molecularly programmed self-assembly with top-down structuring such as lithography and surface templating, as presented in Volume 7. It encompasses polymer and nanoparticle assembly in bulk and under confined conditions or influenced by an external field, including thin films, inorganic-organic hybrids, or nanofibers. Volume 8 expands these concepts focusing on applications in advanced technologies, e.g. in electronic industry and centers on combination with top down approach and functional properties like conductivity. Another type of functionality that is of rapidly increasing importance in polymer science is introduced in volume 9. It deals with various aspects of polymers in biology and medicine, including the response of living cells and tissue to the contact with biofunctional particles and surfaces. The last volume is devoted to the scope and potential provided by environmentally benign and green polymers, as well as energy-related polymers. They discuss new technologies needed for a sustainable economy in our world of limited resources. Provides broad and in-depth coverage of all aspects of polymer science from synthesis/polymerization, properties, and characterization methods and techniques to nanostructures, sustainability and energy, and biomedical uses of polymers Provides a definitive source for those entering or researching in this area by integrating the multidisciplinary aspects of the science into one unique, up-to-date reference work Electronic version has complete cross-referencing and multi-media components Volume editors are world experts in their field (including a Nobel Prize winner)

Crystallization in Multiphase Polymer Systems

Crystallization in Multiphase Polymer Systems PDF Author: Sabu Thomas
Publisher: Elsevier
ISBN: 0128094311
Category : Technology & Engineering
Languages : en
Pages : 612

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Book Description
Crystallization in Multiphase Polymer Systems is the first book that explains in depth the crystallization behavior of multiphase polymer systems. Polymeric structures are more complex in nature than other material structures due to their significant structural disorder. Most of the polymers used today are semicrystalline, and the subject of crystallization is still one of the major issues relating to the performance of semicrystalline polymers in the modern polymer industry. The study of the crystallization processes, crystalline morphologies and other phase transitions is of great significance for the understanding the structure-property relationships of these systems. Crystallization in block copolymers, miscible blends, immiscible blends, and polymer composites and nanocomposites is thoroughly discussed and represents the core coverage of this book. The book critically analyzes the kinetics of nucleation and growth process of the crystalline phases in multi-component polymer systems in different length scales, from macro to nanoscale. Various experimental techniques used for the characterization of polymer crystallization process are discussed. Written by experts in the field of polymer crystallization, this book is a unique source and enables professionals and students to understand crystallization behavior in multiphase polymer systems such as block copolymers, polymer blends, composites and nanocomposites. - Covers crystallization of multiphase polymer systems, including copolymers, blends and nanocomposites - Features comprehensive, detailed information about the basic research, practical applications and new developments for these polymeric materials - Analyzes the kinetics of nucleation and growth process of the crystalline phases in multi-component polymer systems in different length scales, from macro to nanoscale

Scientific and Technical Aerospace Reports

Scientific and Technical Aerospace Reports PDF Author:
Publisher:
ISBN:
Category : Aeronautics
Languages : en
Pages : 236

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Book Description


Modeling and Simulation in Polymer Reaction Engineering

Modeling and Simulation in Polymer Reaction Engineering PDF Author: Klaus-Dieter Hungenberg
Publisher: John Wiley & Sons
ISBN: 3527685758
Category : Technology & Engineering
Languages : en
Pages : 305

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Book Description
Introducing a unique, modular approach to modeling polymerization reactions, this useful book will enable practitioners - chemists and engineers alike - to set up and structure their own models for simulation software like Predici®, C++, MatLab® or others. The generic modules are exemplified for concrete situations for various reactor types and reaction mechanisms and allow readers to quickly find their own point of interest - a highly useful information source for polymer engineers and researchers in industry and academia.

Topology and Geometry in Polymer Science

Topology and Geometry in Polymer Science PDF Author: Stuart G. Whittington
Publisher: Springer Science & Business Media
ISBN: 1461217121
Category : Mathematics
Languages : en
Pages : 209

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Book Description
This IMA Volume in Mathematics and its Applications TOPOLOGY AND GEOMETRY IN POLYMER SCIENCE is based on the proceedings of a very successful one-week workshop with the same title. This workshop was an integral part of the 1995-1996 IMA program on "Mathematical Methods in Materials Science." We would like to thank Stuart G. Whittington, De Witt Sumners, and Timothy Lodge for their excellent work as organizers of the meeting and for editing the proceedings. We also take this opportunity to thank the National Science Foun dation (NSF), the Army Research Office (ARO) and the Office of Naval Research (ONR), whose financial support made the workshop possible. A vner Friedman Robert Gulliver v PREFACE This book is the product of a workshop on Topology and Geometry of Polymers, held at the IMA in June 1996. The workshop brought together topologists, combinatorialists, theoretical physicists and polymer scientists, who share an interest in characterizing and predicting the microscopic en tanglement properties of polymers, and their effect on macroscopic physical properties.

Soft and Fragile Matter

Soft and Fragile Matter PDF Author: Michael E. Cates
Publisher: CRC Press
ISBN: 9781420033519
Category : Science
Languages : en
Pages : 956

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Book Description
Covering colloids, polymers, surfactant phases, emulsions, and granular media, Soft and Fragile Matter: Nonequilibrium Dynamics, Metastability and Flow (PBK) provides self-contained and pedagogical coverage of the rapidly advancing field of systems driven out of equilibrium, with a strong emphasis on unifying conceptual principles rather than material-specific details. Written by internationally recognized experts, the book contains introductions at the level of a graduate course in soft condensed matter and statistical physics to the following areas: experimental techniques, polymers, rheology, colloids, computer simulation, surfactants, phase separation kinetics, driven systems, structural glasses, slow dynamics, and granular materials. These topics lead to a range of exciting applications at the forefront of current research, including microplasticity of emulsions, sequence design of copolymers, branched polymer dynamics, nucleation kinetics in colloids, multiscale modeling, flow-induced surfactant textures, fluid demixing under shear, two-time correlation functions, chaotic sedimentation dynamics, and sound propagation in powders. Balancing theory, simulation, and experiment, this broadly-based, pedagogical account of a rapidly developing field is an excellent compendium for graduate students and researchers in condensed matter physics, materials science, and physical chemistry.