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.
In December 2002, the world's first commercial magnetic levitation super-train went into operation in Shanghai. The train is held just above the rails by magnetic levitation (maglev) and can travel at a speed of 400 km/hr, completing the 30km journey from the city to the airport in minutes. Now consumers are enjoying 50 GB hard drives compared to 0.5 GB hard drives ten years ago. Achievements in magnetic materials research have made dreams of a few decades ago reality. The objective of the four volume reference, Handbook of Advanced Magnetic Materials, is to provide a comprehensive review of recent progress in magnetic materials research. Each chapter will have an introduction to give a clear definition of basic and important concepts of the topic. The details of the topic are then elucidated theoretically and experimentally. New ideas for further advancement are then discussed. Sufficient references are also included for those who wish to read the original work. In the last decade, one of the most significant thrust areas of materials research has been nanostructured magnetic materials. There are several critical sizes that control the behavior of a magnetic material, and size effects become especially critical when dimensions approach a few nanometers, where quantum phenomena appear. The first volume of the book, Nanostructured Advanced Magnetic Materials, has therefore been devoted to the recent development of nanostructured magnetic materials, emphasizing size effects. Our understanding of magnetism has advanced with the establishment of the theory of atomic magnetic moments and itinerant magnetism. Simulation is a powerful tool for exploration and explanation of properties of various magnetic materials. Simulation also provides insight for further development of new materials. Naturally, before any simulation can be started, a model must be constructed. This requires that the material be well characterized. Therefore the second volume, Characterization and Simulation provides a comprehensive review of both experimental methods and simulation techniques for the characterization of magnetic materials. After an introduction, each section gives a detailed description of the method and the following sections provide examples and results of the method. Finally further development of the method will be discussed. The success of each type of magnetic material depends on its properties and cost which are directly related to its fabrication process. Processing of a material can be critical for development of artificial materials such as multilayer films, clusters, etc. Moreover, cost-effective processing usually determines whether a material can be commercialized. In recent years processing of materials has continuously evolved from improvement of traditional methods to more sophisticated and novel methods. The objective of the third volume, Processing of Advanced Magnetic Materials, is to provide a comprehensive review of recent developments in processing of advanced magnetic materials. Each chapter will have an introduction and a section to provide a detailed description of the processing method. The following sections give detailed descriptions of the processing, properties and applications of the relevant materials. Finally the potential and limitation of the processing method will be discussed. The properties of a magnetic material can be characterized by intrinsic properties such as anisotropy, saturation magnetization and extrinsic properties such as coercivity. The properties of a magnetic material can be affected by its chemical composition and processing route. With the continuous search for new materials and invention of new processing routes, magnetic properties of materials cover a wide spectrum of soft magnetic materials, hard magnetic materials, recording materials, sensor materials and other
Volume 15 of the Handbook on the Properties of Magnetic Materials, as the preceding volumes, has a dual purpose. As a textbook it is intended to be of assistance to those who wish to be introduced to a given topic in the field of magnetism without the need to read the vast amount of literature published. As a work of reference it is intended for scientists active in magnetism research. To this dual purpose, Volume 15 of the Handbook is composed of topical review articles written by leading authorities. In each of these articles an extensive description is given in graphical as well as in tabular form, much emphasis being placed on the discussion of the experimental material in the framework of physics, chemistry and material science. It provides the readership with novel trends and achievements in magnetism.
Using Multiscale Modeling to Invigorate Engineering Design with Science
Author: Mark F. Horstemeyer
Publisher: John Wiley & Sons
Category: Technology & Engineering
State-of-the-technology tools for designing, optimizing, and manufacturing new materials Integrated computational materials engineering (ICME) uses computational materials science tools within a holistic system in order to accelerate materials development, improve design optimization, and unify design and manufacturing. Increasingly, ICME is the preferred paradigm for design, development, and manufacturing of structural products. Written by one of the world's leading ICME experts, this text delivers a comprehensive, practical introduction to the field, guiding readers through multiscale materials processing modeling and simulation with easy-to-follow explanations and examples. Following an introductory chapter exploring the core concepts and the various disciplines that have contributed to the development of ICME, the text covers the following important topics with their associated length scale bridging methodologies: Macroscale continuum internal state variable plasticity and damage theory and multistage fatigue Mesoscale analysis: continuum theory methods with discrete features and methods Discrete dislocation dynamics simulations Atomistic modeling methods Electronics structures calculations Next, the author provides three chapters dedicated to detailed case studies, including "From Atoms to Autos: A Redesign of a Cadillac Control Arm," that show how the principles and methods of ICME work in practice. The final chapter examines the future of ICME, forecasting the development of new materials and engineering structures with the help of a cyberinfrastructure that has been recently established. Integrated Computational Materials Engineering (ICME) for Metals is recommended for both students and professionals in engineering and materials science, providing them with new state-of-the-technology tools for selecting, designing, optimizing, and manufacturing new materials. Instructors who adopt this text for coursework can take advantage of PowerPoint lecture notes, a questions and solutions manual, and tutorials to guide students through the models and codes discussed in the text.
A fully illustrated reference book giving an easy-to-understand introduction to compliant mechanisms A broad compilation of compliant mechanisms to give inspiration and guidance to those interested in using compliant mechanisms in their designs, the Handbook of Compliant Mechanisms includes graphics and descriptions of many compliant mechanisms. It comprises an extensive categorization of devices that can be used to help readers identify compliant mechanisms related to their application. It also provides chapters on the basic background in compliant mechanisms, the categories of compliant mechanisms, and an example of how the Compendium can be used to facilitate compliant mechanism design. Fully illustrated throughout to be easily understood and accessible at introductory levels Covers all aspects pertaining to classification, elements, mechanisms and applications of compliant mechanisms Summarizes a vast body of knowledge in easily understood diagrams and explanations Helps readers appreciate the advantages that compliant mechanisms have to offer Practical approach is ideal for potential practitioners who would like to realize designs with compliant mechanisms, members and elements Breadth of topics covered also makes the book a useful reference for more advanced readers Intended as an introduction to the area, the Handbook avoids technical jargon to assist non engineers involved in product design, inventors and engineers in finding clever solutions to problems of design and function.
Since the publication of the best-selling first edition, the growing price and environmental cost of energy have increased the significance of tribology. Handbook of Lubrication and Tribology, Volume II: Theory and Design, Second Edition demonstrates how the principles of tribology can address cost savings, energy conservation, and environmental protection. This second edition provides a thorough treatment of established knowledge and practices, along with detailed references for further study. Written by the foremost experts in the field, the book is divided into four sections. The first reviews the basic principles of tribology, wear mechanisms, and modes of lubrication. The second section covers the full range of lubricants/coolants, including mineral oil, synthetic fluids, and water-based fluids. In the third section, the contributors describe many wear- and friction-reducing materials and treatments, which are currently the fastest growing areas of tribology, with announcements of new coatings, better performance, and new vendors being made every month. The final section presents components, equipment, and designs commonly found in tribological systems. It also examines specific industrial areas and their processes. Sponsored by the Society of Tribologists and Lubrication Engineers, this handbook incorporates up-to-date, peer-reviewed information for tackling tribological problems and improving lubricants and tribological systems. The book shows how the proper use of generally accepted tribological practices can save money, conserve energy, and protect the environment.
This publication starts of with a review of plaque imaging techniques, with an introduction of the segmentation techniques for plaque classification and quantification. Many aspects of plaque imaging techniques are presented in this publication, such as; medical image retrieval and database management, MRI techniques to differentiate stable versus high risk atherosclerosis, composition and morphology of atherosclerotic plaque, analysis of the soft tissue based on computer vision techniques, modelling of coronary artery biomechanics, Cardiac CT for the assessment of cardiovascular pathology with an emphasis on the detection of coronary atherosclerosis, technical and practical issues regarding coronary atherosclerotic plaque imaging by CT (focussing on coronary calcium imaging), feasibility of a non-invasive, in vivo determination of the IBS of arterial wall tissue, high resolution ultrasound images of carotid plaques, the problem of reliable features extraction and classification process and a discussion on advanced mathematical techniques to extract spectral information from the RF data to determine the plaque composition.
Volume IA Handbook of Crystal Growth, 2nd Edition (Fundamentals: Thermodynamics and Kinetics) Volume IA addresses the present status of crystal growth science, and provides scientific tools for the following volumes: Volume II (Bulk Crystal Growth) and III (Thin Film Growth and Epitaxy). Volume IA highlights thermodynamics and kinetics. After historical introduction of the crystal growth, phase equilibria, defect thermodynamics, stoichiometry, and shape of crystal and structure of melt are described. Then, the most fundamental and basic aspects of crystal growth are presented, along with the theories of nucleation and growth kinetics. In addition, the simulations of crystal growth by Monte Carlo, ab initio-based approach and colloidal assembly are thoroughly investigated. Volume IB Handbook of Crystal Growth, 2nd Edition (Fundamentals: Transport and Stability) Volume IB discusses pattern formation, a typical problem in crystal growth. In addition, an introduction to morphological stability is given and the phase-field model is explained with comparison to experiments. The field of nanocrystal growth is rapidly expanding and here the growth from vapor is presented as an example. For the advancement of life science, the crystal growth of protein and other biological molecules is indispensable and biological crystallization in nature gives many hints for their crystal growth. Another subject discussed is pharmaceutical crystal growth. To understand the crystal growth, in situ observation is extremely powerful. The observation techniques are demonstrated. Volume IA Explores phase equilibria, defect thermodynamics of Si, stoichiometry of oxides and atomistic structure of melt and alloys Explains basic ideas to understand crystal growth, equilibrium shape of crystal, rough-smooth transition of step and surface, nucleation and growth mechanisms Focuses on simulation of crystal growth by classical Monte Carlo, ab-initio based quantum mechanical approach, kinetic Monte Carlo and phase field model. Controlled colloidal assembly is presented as an experimental model for crystal growth. Volume IIB Describes morphological stability theory and phase-field model and comparison to experiments of dendritic growth Presents nanocrystal growth in vapor as well as protein crystal growth and biological crystallization Interprets mass production of pharmaceutical crystals to be understood as ordinary crystal growth and explains crystallization of chiral molecules Demonstrates in situ observation of crystal growth in vapor, solution and melt on the ground and in space
Vol 2A: Basic Technologies Handbook of Crystal Growth, 2nd Edition Volume IIA (Basic Technologies) presents basic growth technologies and modern crystal cutting methods. Particularly, the methodical fundamentals and development of technology in the field of bulk crystallization on both industrial and research scales are explored. After an introductory chapter on the formation of minerals, ruling historically the basic crystal formation parameters, advanced basic technologies from melt, solution, and vapour being applied for research and production of the today most important materials, like silicon, semiconductor compounds and oxides are presented in detail. The interdisciplinary and general importance of crystal growth for human live are illustrated. Vol 2B: Growth Mechanisms and Dynamics Handbook of Crystal Growth, 2nd Edition Volume IIB (Growth Mechanisms and Dynamics) deals with characteristic mechanisms and dynamics accompanying each bulk crystal growth method discussed in Volume IIA. Before the atoms or molecules pass over from a position in the fluid medium (gas, melt or solution) to their place in the crystalline face they must be transported in the fluid over macroscopic distances by diffusion, buoyancy-driven convection, surface-tension-driven convection, and forced convection (rotation, acceleration, vibration, magnetic mixing). Further, the heat of fusion and the part carried by the species on their way to the crystal by conductive and convective transport must be dissipated in the solid phase by well-organized thermal conduction and radiation to maintain a stable propagating interface. Additionally, segregation and capillary phenomena play a decisional role for chemical composition and crystal shaping, respectively. Today, the increase of high-quality crystal yield, its size enlargement and reproducibility are imperative conditions to match the strong economy. Volume 2A Presents the status and future of Czochralski and float zone growth of dislocation-free silicon Examines directional solidification of silicon ingots for photovoltaics, vertical gradient freeze of GaAs, CdTe for HF electronics and IR imaging as well as antiferromagnetic compounds and super alloys for turbine blades Focuses on growth of dielectric and conducting oxide crystals for lasers and non-linear optics Topics on hydrothermal, flux and vapour phase growth of III-nitrides, silicon carbide and diamond are explored Volume 2B Explores capillarity control of the crystal shape at the growth from the melt Highlights modeling of heat and mass transport dynamics Discusses control of convective melt processes by magnetic fields and vibration measures Includes imperative information on the segregation phenomenon and validation of compositional homogeneity Examines crystal defect generation mechanisms and their controllability Illustrates proper automation modes for ensuring constant crystal growth process Exhibits fundamentals of solution growth, gel growth of protein crystals, growth of superconductor materials and mass crystallization for food and pharmaceutical industries