Atomic or point defects are disturbances of the periodicity of the crystal lattice extending over only a few atomic distances. Many physical and mechanical properties of solids are sensitive to their presence. Furthermore other defects which are crucial to material behaviour are influenced by their interaction with atomic defects. A detailed knowledge of production mechanisms and properties of point defects is therefore essential for assessing and for understanding the atomistic as well as the macroscopic behaviour of materials. As a result of the use of new research methods in recent years, such information is now available for almost all pure metals, for many dilute alloys and for some concentrated alloys. However, a critical and comprehensive collection of these data has so far been missing. The aim of the present volume is to close this gap by sifting, evaluating and compiling data on vacancies and self-interstitial atoms in solid metals. A chapter on the element helium is included because of the exeptional position of He as an "alloying" element and its role in radiation damage phenomena.

High-Entropy Alloys, Second Edition provides a complete review of the current state of the field of high entropy alloys (HEA). Building upon the first edition, this fully updated release includes new theoretical understandings of these materials, highlighting recent developments on modeling and new classes of HEAs, such as Eutectic HEAs and Dual phase HEAs. Due to their unique properties, high entropy alloys have attracted considerable attention from both academics and technologists. This book presents the fundamental knowledge, the spectrum of various alloy systems and their characteristics, key focus areas, and the future scope of the field in terms of research and technological applications. - Provides an up-to-date, comprehensive understanding on the current status of HEAs in terms of theoretical understanding and modeling efforts - Gives a complete idea on alloy design criteria of various classes of HEAs developed so far - Discusses the microstructure property correlations in HEAs in terms of structural and functional properties - Presents a comparison of HEAs with other multicomponent systems, like intermetallics and bulk metallic glasses

Graphene and its derivatives are potential nanomaterials currently being widely investigated for diverse applications due to its exceptional mechanical, electrical, physical, and chemical properties. Examples of the applications include drug delivery, shape memory polymers, gene delivery, biosensor, tissue engineering, flexible electronic devices, antibacterial composites, photovoltaic devices, and physical sensors. Its excellent properties can be used to develop smart nanomaterials with enhanced properties for various advanced applications. There is no doubt that graphene-based nanomaterials are helping to develop next generation technologies with enhancing properties to change people's lifestyles. This book provides an overview of recent research and development of synthesis of graphene and its applications.

Demonstrates how anyone in math, science, and engineering can master DFT calculations Density functional theory (DFT) is one of the most frequently used computational tools for studying and predicting the properties of isolated molecules, bulk solids, and material interfaces, including surfaces. Although the theoretical underpinnings of DFT are quite complicated, this book demonstrates that the basic concepts underlying the calculations are simple enough to be understood by anyone with a background in chemistry, physics, engineering, or mathematics. The authors show how the widespread availability of powerful DFT codes makes it possible for students and researchers to apply this important computational technique to a broad range of fundamental and applied problems. Density Functional Theory: A Practical Introduction offers a concise, easy-to-follow introduction to the key concepts and practical applications of DFT, focusing on plane-wave DFT. The authors have many years of experience introducing DFT to students from a variety of backgrounds. The book therefore offers several features that have proven to be helpful in enabling students to master the subject, including: Problem sets in each chapter that give readers the opportunity to test their knowledge by performing their own calculations Worked examples that demonstrate how DFT calculations are used to solve real-world problems Further readings listed in each chapter enabling readers to investigate specific topics in greater depth This text is written at a level suitable for individuals from a variety of scientific, mathematical, and engineering backgrounds. No previous experience working with DFT calculations is needed.

This book explains concepts of transmission electron microscopy (TEM) and x-ray diffractometry (XRD) that are important for the characterization of materials. The fourth edition adds important new techniques of TEM such as electron tomography, nanobeam diffraction, and geometric phase analysis. A new chapter on neutron scattering completes the trio of x-ray, electron and neutron diffraction. All chapters were updated and revised for clarity. The book explains the fundamentals of how waves and wavefunctions interact with atoms in solids, and the similarities and differences of using x-rays, electrons, or neutrons for diffraction measurements. Diffraction effects of crystalline order, defects, and disorder in materials are explained in detail. Both practical and theoretical issues are covered. The book can be used in an introductory-level or advanced-level course, since sections are identified by difficulty. Each chapter includes a set of problems to illustrate principles, and the extensive Appendix includes laboratory exercises.