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Titlebook: Computer Simulation of Polymeric Materials; Applications of the Japan Association for‘Chemical Innovation Book 2016 Springer Science+Busin

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發(fā)表于 2025-3-21 16:44:08 | 只看該作者 |倒序?yàn)g覽 |閱讀模式
書目名稱Computer Simulation of Polymeric Materials
副標(biāo)題Applications of the
編輯Japan Association for‘Chemical Innovation
視頻videohttp://file.papertrans.cn/234/233919/233919.mp4
概述Is the first published sourcebook on the OCTA system.Introduces many practical examples from researchers in both academia and industry.Includes detailed processes and tips on simulation that readers c
圖書封面Titlebook: Computer Simulation of Polymeric Materials; Applications of the Japan Association for‘Chemical Innovation Book 2016 Springer Science+Busin
描述This book is the first to introduce a mesoscale polymer simulation system called OCTA. With its name derived from "Open Computational Tool for Advanced material technology," OCTA is a unique software product, available without charge, that was developed in a project funded by Japanese government. OCTA contains a series of simulation programs focused on mesoscale simulation of the soft matter COGNAC, SUSHI, PASTA, NAPLES, MUFFIN, and KAPSEL. When mesoscale polymer simulation is performed, one may encounter many difficulties that this book will help to overcome. The book not only introduces the theoretical background and functions of each simulation engine, it also provides many examples of the practical applications of the OCTA system. Those examples include predicting mechanical properties of plastic and rubber, morphology formation of polymer blends and composites, the micelle structure of surfactants, and optical properties of polymer films. This volume is strongly recommended as a valuable resource for both academic and industrial researchers who work in polymer simulation.
出版日期Book 2016
關(guān)鍵詞Polymer simulation; Coarse-grained model; Mesoscale simulation; Multiscale simulation; Soft material sim
版次1
doihttps://doi.org/10.1007/978-981-10-0815-3
isbn_softcover978-981-10-9259-6
isbn_ebook978-981-10-0815-3
copyrightSpringer Science+Business Media Singapore 2016
The information of publication is updating

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沙發(fā)
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板凳
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Overview of OCTA for input and output, and GOURMET can be used to edit and analyze UDF files. Engines can easily collaborate with each other using UDF files. The UDF also has many facilities that help users easily and flexibly analyze the data. OCTA includes an extended version of the powerful scripting language Py
地板
發(fā)表于 2025-3-22 06:06:46 | 只看該作者
COGNAC: Coarse-Grained Molecular Dynamics Simulatoration). COGNAC provides many kinds of potential functions that enable various kinds of molecular models from full atomistic to coarse-grained bead–spring models to be handled. In addition to conventional molecular dynamics, COGNAC is also suitable for studying the higher-order structure and physical
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KAPSEL: Colloidal Dispersion Simulatormethod, which is a unique numerical method for direct numerical simulations of dispersions of colloidal particles and arbitrarily shaped rigid bodies moving in viscous fluids. The smoothed profile method allows us to compute the time evolutions of colloidal particles, ions, and host fluids simultane
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發(fā)表于 2025-3-23 02:25:50 | 只看該作者
Melt Viscoelasticityach the equilibrium state. However, coarse-grained polymer molecules can be used to treat chain entanglement directly. In the study described in the present chapter, the coarse-grained bead–spring model as an analogy of a real polymer chain was applied to an actual polymer material to determine its
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Crystallization of Polymersarification of molecular mechanisms of polymer crystallization. Despite great efforts to uncover the mechanism of polymer crystallization by experiment, it remains a difficult problem owing to the complexity of the molecular structures. Computer simulations have recently emerged as promising tools w
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