Defects in Solids

The connection between the quantum behavior of the structure elements of a substance and the parameters that determine the macroscopic behavior of materials has a major influence on the properties exhibited by different solids. Although quantum engineering and theory should complement each other, this is not always the case. This book aims to demonstrate how the properties of materials can be derived and predicted from the features of their structural elements, generally electrons. In a sense, electronic structure forms the glue holding solids together and it is central to determining structural, mechanical, chemical, electrical, magnetic, and vibrational properties. The main part of the book is devoted to an overview of the fundamentals of density functional theory and its applications to computational solid-state physics and chemistry. The author shows the technique for construction of models and the computer simulation methods in detail. He considers fundamentals of physical and chemical interatomic bonding in solids and analyzes the predicted theoretical outcome in comparison with experimental data. He applies first-principle simulation methods to predict the properties of transition metals, semiconductors, oxides, solid solutions, and molecular and ionic crystals. Uniquely, he presents novel theories of creep and fatigue that help to anticipate, and prevent, possibly fatal material failures. As a result, readers gain the knowledge and tools to simulate material properties and design materials with desired characteristics. Due to the interdisciplinary nature of the book, it is suitable for a variety of markets from students to engineers and researchers.

This book investigates the possible ways of improvement by applying more sophisticated electronic structure methods as well as corrections and alternatives to the supercell model. In particular, the merits of hybrid and screened functionals, as well as of the +U methods are assessed in comparison to various perturbative and Quantum Monte Carlo many body theories. The inclusion of excitonic effects is also discussed by way of solving the Bethe-Salpeter equation or by using time-dependent DFT, based on GW or hybrid functional calculations. Particular attention is paid to overcome the side effects connected to finite size modeling. The editors are well known authorities in this field, and very knowledgeable of past developments as well as current advances. In turn, they have selected respected scientists as chapter authors to provide an expert view of the latest advances. The result is a clear overview of the connections and boundaries between these methods, as well as the broad criteria determining the choice between them for a given problem. Readers will find various correction schemes for the supercell model, a description of alternatives by applying embedding techniques, as well as algorithmic improvements allowing the treatment of an ever larger number of atoms at a high level of sophistication.

Elastic waves are used in fields as diverse as the non-destructive evaluation of materials, medicine, seismology and telecommunications. Elastic Waves in Solids 1 presents the different modes of propagation of elastic waves in increasingly complex media and structures. It first studies the propagation in an unlimited solid where only the material properties are taken into account. It then analyzes reflection and transmission phenomena at an interface with a fluid or a second solid.

It explains the search for propagation modes on a free surface or at the interface between two media. Finally, it proposes a study of the dispersive propagation of elastic waves guided by a plate or a cylinder. This book is intended for students completing a master’s degree in acoustics, mechanics, geophysics or engineering, as well as teachers and researchers in these disciplines.

Nonlinear Acoustic Waves in Micro-inhomogeneous Solids covers the broad and dynamic branch of nonlinear acoustics, presenting a wide variety of different phenomena from both experimental and theoretical perspectives. The introductory chapters, written in the style of graduate-level textbook, present a review of the main achievements of classic nonlinear acoustics of homogeneous media. This enables readers to gain insight into nonlinear wave processes in homogeneous and micro-inhomogeneous solids and compare it within the framework of the book. The subsequent eight chapters covering: Physical models and mechanisms of the structure nonlinearity of micro-inhomogeneous media with cracks and cavities; Elastic waves in media with strong acoustic nonlinearity; Wave processes in micro-inhomogeneous media with hysteretic nonlinearity; Wave processes in nonlinear micro-inhomogeneous media with relaxation; Wave processes in the polycrystalline solids with dissipative and elastic nonlinearity caused by dislocations; Experimental studies of the nonlinear acoustic phenomena in polycrystalline rocks and metals; Experimental studies of nonlinear acoustic phenomena in granular media; and Nonlinear phenomena in seismic waves are dedicated to the theoretical and experimental research of nonlinear processes, caused by longitudinal elastic waves propagation and interaction in the micro-inhomogeneous media with a strong acoustical nonlinearity of different types (elastic, hysteretic, bimodular, elastic quadratic and non-elastic). This valuable monograph is intended for graduate students and researchers in applied physics, mechanical engineering, and applied mathematics, as well as those working in a wide spectrum of disciplines in materials science.

Neural tube defects are the second most common cause of perinatal death from birth defects in the United Kingdom. In this important book, leading scientists evaluate the latest evidence on the causative factors–both genetic and environmental–of these major human congenital malformations. They also discuss prospects for early detection by prenatal screening and for treatment both before and after birth. The extensive coverage encompasses such topics as: formation and patterning of the avian neuraxis, neurulation in mammals and the normal human embryo, folic acid and more.

A complete overview of the topic of viscoplastic flow in metallic solids produced by shear banding  This book presents novel ideas about inelastic deformation and failure of the material in a clear, concise manner. It exposes readers to information that will allow them to acquire the competence and ability to deal with up-to-date manufacturing and failure processes. It also portrays an interdisciplinary and revolutionary understanding of deformation processes in solids. Shear banding's typical mechanism becomes the active cause of viscoplastic flow and not the passive effect.  Viscoplastic Flow in Metallic Solids Produced by Shear Banding  begins with discussing the new physical model of multilevel hierarchy and evolution of micro-shear bands. It then covers the physical motivation and heuristic foundations of theoretical description concerning known results in the literature. It examines the difficulties of applying a direct multiscale integration scheme across the scales. It also presents an extension of the representative volume element (RVE) concept using the general theory of propagating the singular surfaces of the microscopic velocity field sweeping the RVE. It also reveals a new formulation of the description of the shear strain rate generated by the multilevel hierarchy of shear bands in the workflow integration approach, in which information from the simulation at different levels flows. This book:  Presents fresh ideas about inelastic deformation and failure of materials Provides readers with the competence and ability to deal with up-to-date manufacturing and failure processes Sheds light on the interdisciplinary revolution in the recent understanding of deformation processes in solids  Viscoplastic Flow in Metallic Solids Produced by Shear Banding  will appeal to researchers studying physical foundations of inelastic deformation of materials and dealing with numerical simulations of manufacturing processes. It is also an excellent resource for graduate and postgraduate students of material science and mechanical engineering faculties.

Extensively revised and updated, this new edition of a classic text presents a unified approach to crystallography and to the defects found within crystals. The book combines the classical and exact description of symmetry of a perfect crystal with the possible geometries of the major defects-dislocations, stacking faults, point defects, twins, interfaces and the effects of martensitic transformations. A number of important concepts and exciting new topics have been introduced in this second edition, including piezoelectricity, liquid crystals, nanocrystalline concepts, incommensurate materials and the structure of foamed and amorphous solids. The coverage of quasicrystalline materials has been extended, and the data tables, appendices and references have been fully updated. Reinforcing its unrivalled position as the core text for teaching crystallography and crystal defects, each chapter includes problem sets with brief numerical solutions at the end of the book. Detailed worked solutions, supplementary lecture material and computer programs for crystallographic calculations are provided online (http://booksupport.wiley.com).

This book contains material contributed by forward-looking scientists who work at the interface of stem cell research and applied science with the aim to improve human fetal safety and the understanding of human developmental and degenerative disorders. Provides important platforms and contemporary accounts of the state of stem cell research in the fields of toxicology and teratology Considers both in vitro uses of stem cells as platforms for teratology and also stem cellopathies, which are in vivo developmental and degenerative disorders Helps the pharmaceutical industry and safety and environmental authorities validate the status quo of in vitro toxicity test systems based on human pluripotent stem cells and their derivatives

The classic book that presents a unified approach to crystallography and the defects found within crystals, revised and updated This new edition of Crystallography and Crystal Defects explains the modern concepts of crystallography in a clear, succinct manner and shows how to apply these concepts in the analyses of point, line and planar defects in crystalline materials.  Fully revised and updated, this book now includes: Original source references to key crystallographic terms familiar to materials scientists Expanded discussion on the elasticity of cubic materials New content on texture that contains more detail on Euler angles, orientation distribution functions and an expanded discussion on examples of textures in engineering materials Additional content on dislocations in materials of symmetry lower than cubic An expanded discussion of twinning which includes the description and classification of growth twins The inclusion and explanation of results from atomistic modelling of twin boundaries Problem sets with new questions, detailed worked solutions, supplementary lecture material and online computer programs for crystallographic calculations. Written by authors with extensive lecturing experience at undergraduate level, Crystallography and Crystal Defects, Third Edition continues to take its place as the core text on the topic and provides the essential resource for students and researchers in metallurgy, materials science, physics, chemistry, electrical, civil and mechanical engineering.