Download or read book Multi scale Calculation Based on Dual Domain Material Point Method Combined with Molecular Dynamics written by and published by . This book was released on 2017 with total page 129 pages. Available in PDF, EPUB and Kindle. Book excerpt: This dissertation combines the dual domain material point method (DDMP) with molecular dynamics (MD) in an attempt to create a multi-scale numerical method to simulate materials undergoing large deformations with high strain rates. In these types of problems, the material is often in a thermodynamically non-equilibrium state, and conventional constitutive relations are often not available. In this method, the closure quantities, such as stress, at each material point are calculated from a MD simulation of a group of atoms surrounding the material point. Rather than restricting the multi-scale simulation in a small spatial region, such as phase interfaces, or crack tips, this multi-scale method can be used to consider non-equilibrium thermodynamic e ects in a macroscopic domain. This method takes advantage that the material points only communicate with mesh nodes, not among themselves; therefore MD simulations for material points can be performed independently in parallel. First, using a one-dimensional shock problem as an example, the numerical properties of the original material point method (MPM), the generalized interpolation material point (GIMP) method, the convected particle domain interpolation (CPDI) method, and the DDMP method are investigated. Among these methods, only the DDMP method converges as the number of particles increases, but the large number of particles needed for convergence makes the method very expensive especially in our multi-scale method where we calculate stress in each material point using MD simulation. To improve DDMP, the sub-point method is introduced in this dissertation, which provides high quality numerical solutions with a very small number of particles. The multi-scale method based on DDMP with sub-points is successfully implemented for a one dimensional problem of shock wave propagation in a cerium crystal. The MD simulation to calculate stress in each material point is performed in GPU using CUDA to accelerate the computation. The numerical properties of the multiscale method are investigated as well as the results from this multi-scale calculation are compared of particles needed for convergence makes the method very expensive especially in our multi-scale method where we calculate stress in each material point using MD simulation. To improve DDMP, the sub-point method is introduced in this dissertation, which provides high quality numerical solutions with a very small number of particles. The multi-scale method based on DDMP with sub-points is successfully implemented for a one dimensional problem of shock wave propagation in a cerium crystal. The MD simulation to calculate stress in each material point is performed in GPU using CUDA to accelerate the computation. The numerical properties of the multiscale method are investigated as well as the results from this multi-scale calculation are compared with direct MD simulation results to demonstrate the feasibility of the method. Also, the multi-scale method is applied for a two dimensional problem of jet formation around copper notch under a strong impact.
Download or read book Multiscale Modeling Using Molecular Dynamics and Dual Domain Material Point Method written by and published by . This book was released on 2016 with total page 21 pages. Available in PDF, EPUB and Kindle. Book excerpt: For problems involving large material deformation rate, the material deformation time scale can be shorter than the material takes to reach a thermodynamical equilibrium. For such problems, it is difficult to obtain a constitutive relation. History dependency become important because of thermodynamic non-equilibrium. Our goal is to build a multi-scale numerical method which can bypass the need for a constitutive relation. In conclusion, multi-scale simulation method is developed based on the dual domain material point (DDMP). Molecular dynamics (MD) simulation is performed to calculate stress. Since the communication among material points is not necessary, the computation can be done embarrassingly parallel in CPU-GPU platform.
Download or read book Desiderata Geotechnica written by Wei Wu and published by Springer. This book was released on 2019-04-09 with total page 265 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents contributions to a workshop dedicated to Prof. Gerd Gudehus on the occasion of his 80th birthday and held in Vienna, Austria, on 14-16 August 2018. The articles gathered here, many of which were written by former students, friends and colleagues of Prof. Gudehus, cover diverse topics that reflect the breadth and depth of geomechanics research. Consequently, they offer a valuable source of ideas and inspiration on areas ranging from sophisticated constitutive models to advanced numerical methods, from particles to continua, and from fractals of geomaterials to the design of offshore wind turbine foundations.
Download or read book Computational Fluid and Solid Mechanics written by K.J. Bathe and published by Elsevier. This book was released on 2001-05-21 with total page 975 pages. Available in PDF, EPUB and Kindle. Book excerpt: The MIT mission - "to bring together Industry and Academia and to nurture the next generation in computational mechanics is of great importance to reach the new level of mathematical modeling and numerical solution and to provide an exciting research environment for the next generation in computational mechanics." Mathematical modeling and numerical solution is today firmly established in science and engineering. Research conducted in almost all branches of scientific investigations and the design of systems in practically all disciplines of engineering can not be pursued effectively without, frequently, intensive analysis based on numerical computations.The world we live in has been classified by the human mind, for descriptive and analysis purposes, to consist of fluids and solids, continua and molecules; and the analyses of fluids and solids at the continuum and molecular scales have traditionally been pursued separately. Fundamentally, however, there are only molecules and particles for any material that interact on the microscopic and macroscopic scales. Therefore, to unify the analysis of physical systems and to reach a deeper understanding of the behavior of nature in scientific investigations, and of the behavior of designs in engineering endeavors, a new level of analysis is necessary. This new level of mathematical modeling and numerical solution does not merely involve the analysis of a single medium but must encompass the solution of multi-physics problems involving fluids, solids, and their interactions, involving multi-scale phenomena from the molecular to the macroscopic scales, and must include uncertainties in the given data and the solution results. Nature does not distinguish between fluids and solids and does not ever repeat itself exactly.This new level of analysis must also include, in engineering, the effective optimization of systems, and the modeling and analysis of complete life spans of engineering products, from design to fabrication, to possibly multiple repairs, to end of service.
Download or read book Multiscale Analysis of Deformation and Failure of Materials written by Jinghong Fan and published by John Wiley & Sons. This book was released on 2011-06-28 with total page 510 pages. Available in PDF, EPUB and Kindle. Book excerpt: Presenting cutting-edge research and development within multiscale modeling techniques and frameworks, Multiscale Analysis of Deformation and Failure of Materials systematically describes the background, principles and methods within this exciting new & interdisciplinary field. The author’s approach emphasizes the principles and methods of atomistic simulation and its transition to the nano and sub-micron scale of a continuum, which is technically important for nanotechnology and biotechnology. He also pays close attention to multiscale analysis across the micro/meso/macroscopy of a continuum, which has a broad scope of applications encompassing different disciplines and practices, and is an essential extension of mesomechanics. Of equal interest to engineers, scientists, academics and students, Multiscale Analysis of Deformation and Failure of Materials is a multidisciplinary text relevant to those working in the areas of materials science, solid and computational mechanics, bioengineering and biomaterials, and aerospace, automotive, civil, and environmental engineering. Provides a deep understanding of multiscale analysis and its implementation Shows in detail how multiscale models can be developed from practical problems and how to use the multiscale methods and software to carry out simulations Discusses two interlinked categories of multiscale analysis; analysis spanning from the atomistic to the micro-continuum scales, and analysis across the micro/meso/macro scale of continuum.
Download or read book Multiscaling in Molecular and Continuum Mechanics Interaction of Time and Size from Macro to Nano written by G.C. Sih and published by Springer Science & Business Media. This book was released on 2007-11-29 with total page 467 pages. Available in PDF, EPUB and Kindle. Book excerpt: For the first time, a book is being edited to address how results from one scale can be shifted or related to another scale, say from macro to micro or vice versa. The new approach retains the use of the equilibrium mechanics within a scale level such that cross scale results can be connected by scale invariant criteria. Engineers in different disciplines should be able to understand and use the results.
Download or read book Multiscale Materials Modeling for Nanomechanics written by Christopher R. Weinberger and published by Springer. This book was released on 2016-08-30 with total page 554 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Download or read book Multiphysics in Porous Materials written by Zhen (Leo) Liu and published by Springer. This book was released on 2018-07-12 with total page 431 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book summarizes, defines, and contextualizes multiphysics with an emphasis on porous materials. It covers various essential aspects of multiphysics, from history, definition, and scope to mathematical theories, physical mechanisms, and numerical implementations. The emphasis on porous materials maximizes readers’ understanding as these substances are abundant in nature and a common breeding ground of multiphysical phenomena, especially complicated multiphysics. Dr. Liu’s lucid and easy-to-follow presentation serve as a blueprint on the use of multiphysics as a leading edge technique for computer modeling. The contents are organized to facilitate the transition from familiar, monolithic physics such as heat transfer and pore water movement to state-of-the-art applications involving multiphysics, including poroelasticity, thermohydro-mechanical processes, electrokinetics, electromagnetics, fluid dynamics, fluid structure interaction, and electromagnetomechanics. This volume serves as both a general reference and specific treatise for various scientific and engineering disciplines involving multiphysics simulation and porous materials.
Download or read book Multiscale Materials Modeling written by Siegfried Schmauder and published by Walter de Gruyter GmbH & Co KG. This book was released on 2016-08-22 with total page 346 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents current spatial and temporal multiscaling approaches of materials modeling. Recent results demonstrate the deduction of macroscopic properties at the device and component level by simulating structures and materials sequentially on atomic, micro- and mesostructural scales. The book covers precipitation strengthening and fracture processes in metallic alloys, materials that exhibit ferroelectric and magnetoelectric properties as well as biological, metal-ceramic and polymer composites. The progress which has been achieved documents the current state of art in multiscale materials modelling (MMM) on the route to full multi-scaling. Contents: Part I: Multi-time-scale and multi-length-scale simulations of precipitation and strengthening effects Linking nanoscale and macroscale Multiscale simulations on the coarsening of Cu-rich precipitates in α-Fe using kinetic Monte Carlo, Molecular Dynamics, and Phase-Field simulations Multiscale modeling predictions of age hardening curves in Al-Cu alloys Kinetic Monte Carlo modeling of shear-coupled motion of grain boundaries Product Properties of a two-phase magneto-electric composite Part II: Multiscale simulations of plastic deformation and fracture Niobium/alumina bicrystal interface fracture Atomistically informed crystal plasticity model for body-centred cubic iron FE2AT ・ finite element informed atomistic simulations Multiscale fatigue crack growth modeling for welded stiffened panels Molecular dynamics study on low temperature brittleness in tungsten single crystals Multi scale cellular automata and finite element based model for cold deformation and annealing of a ferritic-pearlitic microstructure Multiscale simulation of the mechanical behavior of nanoparticle-modified polyamide composites Part III: Multiscale simulations of biological and bio-inspired materials, bio-sensors and composites Multiscale Modeling of Nano-Biosensors Finite strain compressive behaviour of CNT/epoxy nanocomposites Peptide・zinc oxide interaction
Download or read book Advanced Structural Damage Detection written by Tadeusz Stepinski and published by John Wiley & Sons. This book was released on 2013-05-20 with total page 342 pages. Available in PDF, EPUB and Kindle. Book excerpt: Structural Health Monitoring (SHM) is the interdisciplinary engineering field devoted to the monitoring and assessment of structural health and integrity. SHM technology integrates non-destructive evaluation techniques using remote sensing and smart materials to create smart self-monitoring structures characterized by increased reliability and long life. Its applications are primarily systems with critical demands concerning performance where classical onsite assessment is both difficult and expensive. Advanced Structural Damage Detection: From Theory to Engineering Applications is written by academic experts in the field and provides students, engineers and other technical specialists with a comprehensive review of recent developments in various monitoring techniques and their applications to SHM. Contributing to an area which is the subject of intensive research and development, this book offers both theoretical principles and feasibility studies for a number of SHM techniques. Key features: Takes a multidisciplinary approach and provides a comprehensive review of main SHM techniques Presents real case studies and practical application of techniques for damage detection in different types of structures Presents a number of new/novel data processing algorithms Demonstrates real operating prototypes Advanced Structural Damage Detection: From Theory to Engineering Applications is a comprehensive reference for researchers and engineers and is a useful source of information for graduate students in mechanical and civil engineering
Download or read book Computational Approaches in Physics written by Maria Fyta and published by Morgan & Claypool Publishers. This book was released on 2016-11-01 with total page 166 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational Approaches in Physics reviews computational schemes which are used in the simulations of physical systems. These range from very accurate ab initio techniques up to coarse-grained and mesoscopic schemes. The choice of the method is based on the desired accuracy and computational efficiency. A bottom-up approach is used to present the various simulation methods used in Physics, starting from the lower level and the most accurate methods, up to particle-based ones. The book outlines the basic theory underlying each technique and its complexity, addresses the computational implications and issues in the implementation, as well as present representative examples. A link to the most common computational codes, commercial or open source is listed in each chapter. The strengths and deficiencies of the variety of techniques discussed in this book are presented in detail and visualization tools commonly used to make the simulation data more comprehensive are also discussed. In the end, specific techniques are used as bridges across different disciplines. To this end, examples of different systems tackled with the same methods are presented. The appendices include elements of physical theory which are prerequisites in understanding the simulation methods.
Download or read book Principles of Multiscale Modeling written by Weinan E and published by Cambridge University Press. This book was released on 2011-07-07 with total page 485 pages. Available in PDF, EPUB and Kindle. Book excerpt: A systematic discussion of the fundamental principles, written by a leading contributor to the field.
Download or read book Multiscale Modeling From Macromolecules to Cell Opportunities and Challenges of Biomolecular Simulations written by Valentina Tozzini and published by Frontiers Media SA. This book was released on 2020-10-27 with total page 235 pages. Available in PDF, EPUB and Kindle. Book excerpt: This eBook is a collection of articles from a Frontiers Research Topic. Frontiers Research Topics are very popular trademarks of the Frontiers Journals Series: they are collections of at least ten articles, all centered on a particular subject. With their unique mix of varied contributions from Original Research to Review Articles, Frontiers Research Topics unify the most influential researchers, the latest key findings and historical advances in a hot research area! Find out more on how to host your own Frontiers Research Topic or contribute to one as an author by contacting the Frontiers Editorial Office: frontiersin.org/about/contact.
Download or read book Discrete element Modeling of Granular Materials written by Farhang Radjaï and published by Wiley-ISTE. This book was released on 2011-05-03 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book brings together in a single volume various methods and skills for particle-scale or discrete-element numerical simulation of granular media. It covers a broad range of topics from basic concepts and methods towards more advanced aspects and technical details applicable to the current research on granular materials. Discrete-element simulations of granular materials are based on four basic models (molecular dynamics, contact dynamics, quasi-static and event driven) dealing with frictional contact interactions and integration schemes for the equations of dynamics. These models are presented in the first chapters of the book, followed by various methods for sample preparation and monitoring of boundary conditions, as well as dimensionless control parameters. Granular materials encountered in real life involve a variety of compositions (particle shapes and size distributions) and interactions (cohesive, hydrodynamic, thermal) that have been extensively covered by several chapters. The book ends with two applications in the field of geo-materials.
Download or read book Nano Mechanics and Materials written by Wing Kam Liu and published by John Wiley & Sons. This book was released on 2006-08-30 with total page 334 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Download or read book Handbook of Materials Modeling written by Sidney Yip and published by Springer Science & Business Media. This book was released on 2007-11-17 with total page 2903 pages. Available in PDF, EPUB and Kindle. Book excerpt: The first reference of its kind in the rapidly emerging field of computational approachs to materials research, this is a compendium of perspective-providing and topical articles written to inform students and non-specialists of the current status and capabilities of modelling and simulation. From the standpoint of methodology, the development follows a multiscale approach with emphasis on electronic-structure, atomistic, and mesoscale methods, as well as mathematical analysis and rate processes. Basic models are treated across traditional disciplines, not only in the discussion of methods but also in chapters on crystal defects, microstructure, fluids, polymers and soft matter. Written by authors who are actively participating in the current development, this collection of 150 articles has the breadth and depth to be a major contributor toward defining the field of computational materials. In addition, there are 40 commentaries by highly respected researchers, presenting various views that should interest the future generations of the community. Subject Editors: Martin Bazant, MIT; Bruce Boghosian, Tufts University; Richard Catlow, Royal Institution; Long-Qing Chen, Pennsylvania State University; William Curtin, Brown University; Tomas Diaz de la Rubia, Lawrence Livermore National Laboratory; Nicolas Hadjiconstantinou, MIT; Mark F. Horstemeyer, Mississippi State University; Efthimios Kaxiras, Harvard University; L. Mahadevan, Harvard University; Dimitrios Maroudas, University of Massachusetts; Nicola Marzari, MIT; Horia Metiu, University of California Santa Barbara; Gregory C. Rutledge, MIT; David J. Srolovitz, Princeton University; Bernhardt L. Trout, MIT; Dieter Wolf, Argonne National Laboratory.
Download or read book Lattice Gas Cellular Automata and Lattice Boltzmann Models written by Dieter A. Wolf-Gladrow and published by Springer. This book was released on 2004-10-19 with total page 320 pages. Available in PDF, EPUB and Kindle. Book excerpt: Lattice-gas cellular automata (LGCA) and lattice Boltzmann models (LBM) are relatively new and promising methods for the numerical solution of nonlinear partial differential equations. The book provides an introduction for graduate students and researchers. Working knowledge of calculus is required and experience in PDEs and fluid dynamics is recommended. Some peculiarities of cellular automata are outlined in Chapter 2. The properties of various LGCA and special coding techniques are discussed in Chapter 3. Concepts from statistical mechanics (Chapter 4) provide the necessary theoretical background for LGCA and LBM. The properties of lattice Boltzmann models and a method for their construction are presented in Chapter 5.
