Multiscale Simulation Methods For Nanomaterials


Multiscale Simulation Methods For Nanomaterials
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Multiscale Simulation Methods For Nanomaterials


Multiscale Simulation Methods For Nanomaterials
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Author : Richard B. Ross
language : en
Publisher: John Wiley & Sons
Release Date : 2008-02-04

Multiscale Simulation Methods For Nanomaterials written by Richard B. Ross and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2008-02-04 with Science categories.


This book stems from the American Chemical Society symposium, Large Scale Molecular Dynamics, Nanoscale, and Mesoscale Modeling and Simulation: Bridging the Gap, that delved into the latest methodologies and applications for largescale, multiscale, and mesoscale modeling and simulation. It presents real-world applications of simulated and synthesized materials, including organic-, inorganic-, bio-, and nanomaterials, and helps readers determine the best method for their simulation. It gets novices up to speed quickly and helps experienced practitioners discover novel approaches and alternatives.



Multiscale Modelling Of Advanced Materials


Multiscale Modelling Of Advanced Materials
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Author : Runa Kumari
language : en
Publisher: Springer Nature
Release Date : 2020-02-08

Multiscale Modelling Of Advanced Materials written by Runa Kumari and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-02-08 with Technology & Engineering categories.


This volume covers the recent advances and research on the modeling and simulation of materials. The primary aim is to take the reader through the mathematical analysis to the theories of electricity and magnetism using multiscale modelling, covering a variety of numerical methods such as finite difference time domain (FDTD), finite element method (FEM) and method of moments. The book also introduces the multiscale Green’s function (GF) method for static and dynamic modelling and simulation results of modern advanced nanomaterials, particularly the two-dimensional (2D) materials. This book will be of interest to researchers and industry professionals working on advanced materials.



Multiscale Materials Modeling For Nanomechanics


Multiscale Materials Modeling For Nanomechanics
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Author : Christopher R. Weinberger
language : en
Publisher: Springer
Release Date : 2016-08-30

Multiscale Materials Modeling For Nanomechanics written by Christopher R. Weinberger and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2016-08-30 with Technology & Engineering categories.


This book presents a unique combination of chapters that together provide a practical introduction to multiscale modeling applied to nanoscale materials mechanics. The goal of this book is to present a balanced treatment of both the theory of the methodology, as well as some practical aspects of conducting the simulations and models. The first half of the book covers some fundamental modeling and simulation techniques ranging from ab-inito methods to the continuum scale. Included in this set of methods are several different concurrent multiscale methods for bridging time and length scales applicable to mechanics at the nanoscale regime. The second half of the book presents a range of case studies from a varied selection of research groups focusing either on a the application of multiscale modeling to a specific nanomaterial, or novel analysis techniques aimed at exploring nanomechanics. Readers are also directed to helpful sites and other resources throughout the book where the simulation codes and methodologies discussed herein can be accessed. Emphasis on the practicality of the detailed techniques is especially felt in the latter half of the book, which is dedicated to specific examples to study nanomechanics and multiscale materials behavior. An instructive avenue for learning how to effectively apply these simulation tools to solve nanomechanics problems is to study previous endeavors. Therefore, each chapter is written by a unique team of experts who have used multiscale materials modeling to solve a practical nanomechanics problem. These chapters provide an extensive picture of the multiscale materials landscape from problem statement through the final results and outlook, providing readers with a roadmap for incorporating these techniques into their own research.



Nano Mechanics And Materials


Nano Mechanics And Materials
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Author : Wing Kam Liu
language : en
Publisher: John Wiley & Sons
Release Date : 2006-08-30

Nano Mechanics And Materials written by Wing Kam Liu and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2006-08-30 with Technology & Engineering categories.


Nanotechnology is a progressive research and development topic with large amounts of venture capital and government funding being invested worldwide. Nano mechanics, in particular, is the study and characterization of the mechanical behaviour of individual atoms, systems and structures in response to various types of forces and loading conditions. This text, written by respected researchers in the field, informs researchers and practitioners about the fundamental concepts in nano mechanics and materials, focusing on their modelling via multiple scale methods and techniques. The book systematically covers the theory behind multi-particle and nanoscale systems, introduces multiple scale methods, and finally looks at contemporary applications in nano-structured and bio-inspired materials.



Computational Methods In Large Scale Simulation


Computational Methods In Large Scale Simulation
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Author : Khin-Yong Lam
language : en
Publisher: World Scientific
Release Date : 2005-10-26

Computational Methods In Large Scale Simulation written by Khin-Yong Lam and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 2005-10-26 with Mathematics categories.


This volume documents the research carried out by visiting scientists attached to the Institute for Mathematical Sciences (IMS) at the National University of Singapore and the Institute of High Performance Computing (IHPC) under the program “Advances and Mathematical Issues in Large Scale Simulation.” From 2002 to 2003, researchers from various countries gathered to initiate interesting and innovative work on various themes related to multiscale simulation and fast algorithms. Today, modeling and simulation are used extensively to solve complex problems and to reduce the use of experimentation during the design and analysis stage. It is important to know the various issues that have to be considered in the successful development of computational methodologies for such work. This volume is a compilation of the research by various visiting scientists in the area of modeling and multiscale simulation. Each article covers a major project and documents how computational methodology, mathematical modeling, high performance computing and simulation are combined in a multiscale scheme to solve a variety of complex problems. Some of these include the design, synthesis, processing, characterization and manufacture of nanomaterials and nanostructures, new algorithms for computational work, and grid computing. Through the included examples, readers can realize the vast potential of computational modeling and large scale simulation for the solution of problems in a variety of disciplines and applications. Contents:Methods of Multiscale Modeling in Mechanics (W A Curtin)Efficient and Accurate Boundary Methods for Computational Optics (C Hafner & J Smajic)Finite Element Modeling of Periodic Structures (Z Lou & J-M Jin)Factorization of Potential and Field Distributions without Utilizing the Addition Theorem (A-R Baghi-Wadji & E Li)Virtualization-Aware Application Framework for Hierarchical Multiscale Simulations on a Grid (A Nakano et al.)Molecular Dynamics Simulation and Local Quantities (T Ikeshoji)Recent Advances in Modeling and Simulation of High-Speed Interconnects (M Nakhla & R Achar)Multiscale Modeling of Degradation and Failure of Interconnect Lines Driven by Electromigration and Stress Gradients (R Atkinson & A M Cuitiño) Readership: Engineers, scientists and graduate students who need further insights into the applications and power of computational methodology for the solution of a wide array of problems. Keywords:Large Scale Simulation;High Performance Computing;Multiscale Simulation;Fast Algorithms;Computational MethodologyKey Features:Provides insight into the applications and power of computational methodology in solving a wide array of complex problems



Multiscale Modeling In Nanophotonics


Multiscale Modeling In Nanophotonics
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Author : Alexander Bagaturyants
language : en
Publisher: CRC Press
Release Date : 2017-11-22

Multiscale Modeling In Nanophotonics written by Alexander Bagaturyants and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-11-22 with Science categories.


The idea of theoretically predicting the useful properties of various materials using multiscale simulations has become popular in recent years. Of special interest are nanostructured, organic functional materials, which have a hierarchical structure and are considered materials of the future because of their flexibility and versatility. Their functional properties are inherited from the molecule that lies at the heart of the hierarchical structure. On the other hand, the properties of this functional molecule, in particular its absorption and emission spectra, strongly depend on its interactions with its molecular environment. Therefore, the multiscale simulations used to predict the properties of organic functional materials should be atomistic, that is, they should be based on classical and/or quantum methods that explicitly take into account the molecular structure and intermolecular interactions at the atomic level. This book, written by well-known specialists in theoretical chemistry, focuses on the basics of classical mechanics, quantum chemistry methods used for molecular disordered materials, classical methods of molecular simulations of disordered materials, vibronic interactions, and applications (presented as multiscale strategies for atomistic simulations of photonic materials). It has been edited by Professor Mikhail Alfimov, a renowned Russian scientist, a full member of the Russian Academy of Sciences, Russia, and the founder, first director, and now research supervisor of the Photochemistry Center of the Russian Academy of Science, Russia. Professor Alfimov’s main research interests are in the field of photochemistry and photophysics of molecular and supramolecular systems. The book is a great reference for advanced undergraduate- and graduate-level students of nanotechnology and molecular science and researchers in nano- and molecular science, nanotechnology, chemistry, and physical chemistry, especially those with an interest in functional materials.



Computational Nanomaterials


Computational Nanomaterials
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Author : Thomas S. Gates
language : en
Publisher: Wiley-Interscience
Release Date : 2008-01

Computational Nanomaterials written by Thomas S. Gates and has been published by Wiley-Interscience this book supported file pdf, txt, epub, kindle and other format this book has been release on 2008-01 with Technology & Engineering categories.


The availability of multi-scale simulation methods provides an opportunity to allow research, development, and marketing of novel systems to occur in a parallel manner, a fact that can greatly facilitate innovation. As a result, much attention has been focused on applying these methods to the study of nanomaterials, owing to their enormous potential in materials applications. This book provides a critical assessment of the current state-of-the-art modeling and simulation techniques used to study the mechanical properties and behavior of novel nanomaterials and composites.



Multiscale And Multiphysics Computational Frameworks For Nano And Bio Systems


Multiscale And Multiphysics Computational Frameworks For Nano And Bio Systems
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Author : Hyungjun Kim
language : en
Publisher: Springer
Release Date : 2010-11-19

Multiscale And Multiphysics Computational Frameworks For Nano And Bio Systems written by Hyungjun Kim and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2010-11-19 with Science categories.


This volume develops multiscale and multiphysics simulation methods to understand nano- and bio-systems by overcoming the limitations of time- and length-scales. Here the key issue is to extend current computational simulation methods to be useful for providing microscopic understanding of complex experimental systems. This thesis discusses the multiscale simulation approaches in nanoscale metal-insulator-metal junction, molecular memory, ionic transport in zeolite systems, dynamics of biomolecules such as lipids, and model lung system. Based on the cases discussed here, the author suggests various systematic strategies to overcome the limitations in time- and length-scales of the traditional monoscale approaches.



Multiscale Modeling


Multiscale Modeling
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Author : Pedro Derosa
language : en
Publisher: CRC Press
Release Date : 2010-12-09

Multiscale Modeling written by Pedro Derosa and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2010-12-09 with Science categories.


While the relevant features and properties of nanosystems necessarily depend on nanoscopic details, their performance resides in the macroscopic world. To rationally develop and accurately predict performance of these systems we must tackle problems where multiple length and time scales are coupled. Rather than forcing a single modeling approach to



Computational Finite Element Methods In Nanotechnology


Computational Finite Element Methods In Nanotechnology
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Author : Sarhan M. Musa
language : en
Publisher: CRC Press
Release Date : 2017-12-19

Computational Finite Element Methods In Nanotechnology written by Sarhan M. Musa and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-12-19 with Science categories.


Computational Finite Element Methods in Nanotechnology demonstrates the capabilities of finite element methods in nanotechnology for a range of fields. Bringing together contributions from researchers around the world, it covers key concepts as well as cutting-edge research and applications to inspire new developments and future interdisciplinary research. In particular, it emphasizes the importance of finite element methods (FEMs) for computational tools in the development of efficient nanoscale systems. The book explores a variety of topics, including: A novel FE-based thermo-electrical-mechanical-coupled model to study mechanical stress, temperature, and electric fields in nano- and microelectronics The integration of distributed element, lumped element, and system-level methods for the design, modeling, and simulation of nano- and micro-electromechanical systems (N/MEMS) Challenges in the simulation of nanorobotic systems and macro-dimensions The simulation of structures and processes such as dislocations, growth of epitaxial films, and precipitation Modeling of self-positioning nanostructures, nanocomposites, and carbon nanotubes and their composites Progress in using FEM to analyze the electric field formed in needleless electrospinning How molecular dynamic (MD) simulations can be integrated into the FEM Applications of finite element analysis in nanomaterials and systems used in medicine, dentistry, biotechnology, and other areas The book includes numerous examples and case studies, as well as recent applications of microscale and nanoscale modeling systems with FEMs using COMSOL Multiphysics® and MATLAB®. A one-stop reference for professionals, researchers, and students, this is also an accessible introduction to computational FEMs in nanotechnology for those new to the field.