molecular modeling and multiscaling issues for electronic material applications volume 2

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Molecular Modeling And Multiscaling Issues For Electronic Material Applications

Author : Artur Wymyslowski
ISBN : 9783319128627
Genre : Technology & Engineering
File Size : 71. 48 MB
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This book offers readers a snapshot of the progression of molecular modeling in the electronics industry and how molecular modeling is currently being used to understand materials to solve relevant issues in this field. The reader is introduced to the evolving role of molecular modeling, especially seen from the perspective of the IEEE community and modeling in electronics. This book also covers the aspects of molecular modeling needed to understand the relationship between structures and mechanical performance of materials. The authors also discuss the transitional topic of multiscale modeling and recent developments on the atomistic scale and current attempts to reach the submicron scale, as well as the role that quantum mechanics can play in performance prediction.


Author : James E. Morris
ISBN : 9783319903620
Genre :
File Size : 55. 68 MB
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Models Databases And Simulation Tools Needed For Realization Of Integrated Computational Mat Eng Icme 2010

Author : Steven M. Arnold and Terry T. Wong, Editors
ISBN : 9781615038435
Genre : Electronic books
File Size : 37. 42 MB
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Multiphysics And Multiscale Modeling

Author : Young W. Kwon
ISBN : 9781482244595
Genre : Science
File Size : 26. 62 MB
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Written to appeal to a wide field of engineers and scientists who work on multiscale and multiphysics analysis, Multiphysics and Multiscale Modeling: Techniques and Applications is dedicated to the many computational techniques and methods used to develop man-made systems as well as understand living systems that exist in nature. Presenting a body of research on multiscale and multiphysics analysis collected by the author over the years, this book provides an assessment of multiple computational techniques that include the finite element method, lattice Boltzmann method, cellular automata, and the molecular dynamics technique. The author also presents a number of example problems relevant to multiphysics and multiscale analyses, and introduces the proper coupling techniques that can be used in conjunction with computational methods to solve a multitude of multiscale and multiphysics problems. In addition, this detailed book: Provides a simplified analysis for crystalline structures using the finite element method and molecular dynamics Discusses multiscale analysis of biomaterials using human bones as an example Presents multiphysics problems for composite structures Includes fluidstructure interaction for composite structures surrounded by water Contains an example of the multiphysics analysis of electromechanical problems Introduces a multiphysics analysis of biomechanics using the example of blood vessels (for which there is fluid-structure interaction) Multiphysics and Multiscale Modeling: Techniques and Applications emphasizes the use of multiphysics and multiscale techniques to aid in the understanding and development of complex physical behaviors and systems. This book serves as a resource in mechanical engineering, bioengineering, and materials engineering study, practice, and research.

Multiscale Materials Modeling For Nanomechanics

Author : Christopher R. Weinberger
ISBN : 9783319334806
Genre : Technology & Engineering
File Size : 71. 80 MB
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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.

Molecular Electronics

Author : Sokrates T. Pantelides
ISBN : UOM:39015049694634
Genre : Technology & Engineering
File Size : 87. 69 MB
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The MRS Symposium Proceeding series is an internationally recognised reference suitable for researchers and practitioners.

Multiscale Modeling For Process Safety Applications

Author : Arnab Chakrabarty
ISBN : 9780123972835
Genre : Technology & Engineering
File Size : 77. 95 MB
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Multiscale Modeling for Process Safety Applications is a new reference demonstrating the implementation of multiscale modeling techniques on process safety applications. It is a valuable resource for readers interested in theoretical simulations and/or computer simulations of hazardous scenarios. As multi-scale modeling is a computational technique for solving problems involving multiple scales, such as how a flammable vapor cloud might behave if ignited, this book provides information on the fundamental topics of toxic, fire, and air explosion modeling, as well as modeling jet and pool fires using computational fluid dynamics. The book goes on to cover nanomaterial toxicity, QPSR analysis on relation of chemical structure to flash point, molecular structure and burning velocity, first principle studies of reactive chemicals, water and air reactive chemicals, and dust explosions. Chemical and process safety professionals, as well as faculty and graduate researchers, will benefit from the detailed coverage provided in this book. Provides the only comprehensive source addressing the use of multiscale modeling in the context of process safety Bridges multiscale modeling with process safety, enabling the reader to understand mapping between problem detail and effective usage of resources Presents an overall picture of addressing safety problems in all levels of modeling and the latest approaches to each in the field Features worked out examples, case studies, and a question bank to aid understanding and involvement for the reader

Trends In Computational Nanomechanics

Author : Traian Dumitrica
ISBN : 1402097859
Genre : Technology & Engineering
File Size : 88. 79 MB
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Trends in Computational Nanomechanics reviews recent advances in analytical and computational modeling frameworks to describe the mechanics of materials on scales ranging from the atomistic, through the microstructure or transitional, and up to the continuum. The book presents new approaches in the theory of nanosystems, recent developments in theoretical and computational methods for studying problems in which multiple length and/or time scales must be simultaneously resolved, as well as example applications in nanomechanics. This title will be a useful tool of reference for professionals, graduates and undergraduates interested in Computational Chemistry and Physics, Materials Science, Nanotechnology.

Computational Multiscale Modeling Of Fluids And Solids

Author : Martin Oliver Steinhauser
ISBN : 9783662532249
Genre : Science
File Size : 26. 78 MB
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The idea of the book is to provide a comprehensive overview of computational physics methods and techniques, that are used for materials modeling on different length and time scales. Each chapter first provides an overview of the basic physical principles which are the basis for the numerical and mathematical modeling on the respective length-scale. The book includes the micro-scale, the meso-scale and the macro-scale, and the chapters follow this classification. The book explains in detail many tricks of the trade of some of the most important methods and techniques that are used to simulate materials on the perspective levels of spatial and temporal resolution. Case studies are included to further illustrate some methods or theoretical considerations. Example applications for all techniques are provided, some of which are from the author’s own contributions to some of the research areas. The second edition has been expanded by new sections in computational models on meso/macroscopic scales for ocean and atmosphere dynamics. Numerous applications in environmental physics and geophysics had been added.

Multiscale Modeling Of Materials 2000

Author : Ladislas P. Kubin
ISBN : UOM:39015049130613
Genre : Technology & Engineering
File Size : 40. 34 MB
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Multiscale modeling of materials has emerged as a powerful tool with application to metals, semiconductors, polymers and biochemical systems. Together with rapid advances in computing power, these new methods represent an important step toward the goal of linking atomic-scale processes - modeled with interatomic potentials, tight-binding and ab initio methods - to simulations of macroscopic phenomena. This volume brings together scientists and engineers from various disciplines to discuss state-of-the-art methodologies for linking disparate length and time scales, and for understanding and predicting the behavior of complex materials systems. The book is organized around several major themes representing current challenges in multiscale simulation and modeling. Topics include: length-scale and time-scale problems; applications to microstructure evolution; plastic deformation and fracture; multiscale modeling schemes; length scales and size effects.

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