Computer simulation of polymers
著者
書誌事項
Computer simulation of polymers
（Polymer science and technology series）
Longman Scientific and Technical, c1994
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注記
Includes bibliographical references and index
内容説明・目次
内容説明
The "Polymer Science and Technology Series" systematically covers a wide range of key areas in polymer technology. Each volume in the series focuses on an individual area of importance in the polymer industry and is edited by acknowledged experts in the field. It takes a detailed look at the complex problems of time and size scaling in molecular modelling and simulation and includes not only atomistic modelling, but also coarse-grained modelling which allows longer time-scales and therefore, larger systems to be studied. Coverage includes applications of: molecular modelling; molecular dynamics and Monte Carlo methods (statistical methods of modelling using random sampling). The book assumes a background knowledge of synthetic polymer properties and simulation.
目次
1. Molecular modelling of polymers. 2. Molecular dynamics modelling of amorphous polymers. 3. Monte Carlo studies of collective of phenomena in dense polymer systems. 4. Molecular modelling of crystalline polymers. 5. Computer simulation of polymer crystallisation. 6. Molecular models for polymer deformation and failure. 7. Monte Carlo simulations of the free energies and phase diagrams of macromolecular systems. 8. Computer simulation of bipolymers.
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