Phase Diagrams: Materials Science and Technology, Volume V is a six-chapter text that covers the use of phase diagrams in the understanding and development of inorganic materials. This volume first examines the atomistic understanding of the geometry of phase diagrams and the thermodynamic parameters on which the diagrams are based, as well as the relations of diagrams to crystal chemistry. The topics are followed by discussions on the most important thermodynamic theories of nonstoichiometry in binary oxide systems and the theories of spinodal decomposition that are relevant to crystalline nonmetals, especially to mixed crystalline oxides. Other chapters explore the phase equilibrium relations of phosphatic apatites including fluor-, chlor-, and hydroxyanion-containing compounds and of sialons and other nitrogen ceramics. The last chapter describes the mechanical, chemical, and thermal shock-resistant properties required of materials for stringent application. This chapter highlights the maximizing of the thermal shock resistance of silicate ceramics through lowering thermal expansion to meet the required properties of this application. The use of phase diagrams in the development of low thermal expansion materials for these applications is also discussed. This book will be useful to all scientists, engineers, and materials science students who are investigating and developing materials, as well as to the end user of the materials.

Refractory Materials: A Series of Monographs Volume IV is a collection of works from different scientists who have made important discoveries in fields related to chemistry. The text covers topics such as chemical vapor deposition – its general aspects, selection of reactions, and parameters; solid-gas phase diagrams and open-tube processes; and the experimental resolution of solid-vapor equilibria. Also covered are topics such as phase behavior and related properties of rare-earth borides, crystal chemistry, the use of phase diagrams in the research and development of phosphor materials, and phase equilibria in magnetic oxide materials. The book is recommended for chemists and materials scientists who would like to know more about the studies of other experts in the field and their applications.

Phase Diagrams: Materials Science and Technology, Volume III is an eight-chapter text that deals with the use of phase diagrams in electronic materials and glass technology. This volume first describes several crystal-growth techniques and the use of phase diagrams in crystals grown from high-temperature systems. This is followed by discussions on phase problems encountered in semiconductor studies with compound semiconductors and the use of phase diagrams in illustrating superconducting state and superconductivity property of materials. A chapter deals with the preparation of metastable phases by rapid quenching from the liquid (splat cooling) and the alloy constitution changes associated with their formation and properties, with a particular emphasis on the phase-diagram representation of metastable alloy phases. The discussion then shifts to metastable liquid immiscibility, occurrence, techniques of study, mechanisms of microphase separation, phase diagrams, and practical applications. This volume also examines the use of phase diagrams to obtain solubility data for high-temperature systems assisting in the prediction of dissolution behavior. The concluding chapters explore the relationships between phase diagrams and the structure of glass-forming oxide and phase studies of molten salts and their interactions with other salts and oxides. This book will be useful to all scientists, engineers, and materials science students who are investigating and developing materials, as well as to the end users of the materials.

Phase Diagrams: Materials Science and Technology, Volume II covers the use of phase diagrams in metals, refractories, ceramics, and cements. Divided into 10 chapters, this volume first describes the main features of phase diagrams representing systems in which the oxygen pressure is an important parameter, starting with binary systems and proceeding toward the more complicated ternary and quaternary systems. The subsequent chapters discuss the application of phase diagrams in several refractory systems. A chapter covers the procedures used for cement production and some of the available phase-equilibrium data and their application to specific situations. This volume also deals with the application of phase diagrams to extraction metallurgy, with an emphasis on oxide systems, as well as in ceramic and metal sintering. The concluding chapters explore the relationship of heat treatment of metals and alloys to their phase diagrams. These chapters also deal with the use of phase diagrams in several techniques of joining metals, such as fusion welding, brazing, solid-state bonding, and soldering. This volume will be useful to all scientists, engineers, and materials science students who are investigating and developing materials, as well as to the end users of the materials.

Specialist Periodical Reports provide systematic and detailed review coverage of progress in the major areas of chemical research. Written by experts in their specialist fields the series creates a unique service for the active research chemist, supplying regular critical in-depth accounts of progress in particular areas of chemistry. For over 80 years the Royal Society of Chemistry and its predecessor, the Chemical Society, have been publishing reports charting developments in chemistry, which originally took the form of Annual Reports. However, by 1967 the whole spectrum of chemistry could no longer be contained within one volume and the series Specialist Periodical Reports was born. The Annual Reports themselves still existed but were divided into two, and subsequently three, volumes covering Inorganic, Organic and Physical Chemistry. For more general coverage of the highlights in chemistry they remain a 'must'. Since that time the SPR series has altered according to the fluctuating degree of activity in various fields of chemistry. Some titles have remained unchanged, while others have altered their emphasis along with their titles; some have been combined under a new name whereas others have had to be discontinued.

Computational Methods for Microstructure-Property Relationships introduces state-of-the-art advances in computational modeling approaches for materials structure-property relations. Written with an approach that recognizes the necessity of the engineering computational mechanics framework, this volume provides balanced treatment of heterogeneous materials structures within the microstructural and component scales. Encompassing both computational mechanics and computational materials science disciplines, this volume offers an analysis of the current techniques and selected topics important to industry researchers, such as deformation, creep and fatigue of primarily metallic materials. Researchers, engineers and professionals involved with predicting performance and failure of materials will find Computational Methods for Microstructure-Property Relationships a valuable reference.

This book compiles selected publications authored or co-authored by the editor to present a comprehensive understanding of following topics: (1) density functional theory and CALPHAD modeling; (2) computational tools; and (3) applications of computational thermodynamics. It is noted that while entropy at one scale is well represented by standard statistical mechanics in terms of probability of individual configurations at that scale, the theory capable of counting total entropy of a system from different scales is lacking. The zentropy theory provides a nested form for configurational entropy enabling multiscale modeling to account for disorder and fluctuations from the electronic scale based on quantum mechanics to the experimental scale based on statistical mechanics using free energies of individual configurations rather than their total energies in standard statistical mechanics. The predictions from the zentropy theory demonstrate remarkable agreements with experimental observations for magnetic transitions and associated emergent behaviors of strongly correlated metals and oxides, including singularity and instability at critical points and positive and negative thermal expansions, without the need of additional truncated models and fitting model parameters beyond density function theory. This paves the way to provide the predicted phase equilibrium data for high throughput predictive CALPHAD modeling of complex material systems, and those individual configurations may thus be considered as the genomic building blocks of individual phases in the spirit of Materials Genome®.