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The SGTE Casebook
The Scientific Group Thermodata Europe (SGTE) is a consortium involved in the development and application of thermodynamic databanks for materials such as metals. Building on SGTE research, the second edition of this standard reference presents thermodynamic calculations as the basic tools in developing and optimizing various materials and processes. The SGTE Casebook: Thermodynamics at Work, Second Edition shows how this data can optimize the production and quality of steel and other alloys. The book explores phases stable at equilibrium as well as their amounts and compositions, and provides information about the degree of instability of the phases not present at equilibrium
Computational Thermodynamics
Phase diagrams are used in materials research and engineering to understand the interrelationship between composition, microstructure and process conditions. In complex systems, computational methods such as CALPHAD are employed to model thermodynamic properties for each phase and simulate multicomponent phase behavior. Written by recognized experts in the field, this is the first introductory guide to the CALPHAD method, providing a theoretical and practical approach. Building on core thermodynamic principles, this book applies crystallography, first principles methods and experimental data to computational phase behavior modeling using the CALPHAD method. With a chapter dedicated to creating thermodynamic databases, the reader will be confident in assessing, optimizing and validating complex thermodynamic systems alongside database construction and manipulation. Several case studies put the methods into a practical context, making this suitable for use on advanced materials design and engineering courses and an invaluable reference to those using thermodynamic data in their research or simulations.
Thermodynamics
This book presents the selection of various high level contributions involving thermodynamics. The book goes from the fundamentals up to several applications in different scientific fields. The content of the book has been classified in six sections: Classical Thermodynamics, Statistical Thermodynamics, Property Prediction in Thermodynamics, Material and Products, Non Equilibrium and Thermodynamics in Diverse Areas. The classification of the book aims to provide to the reader the facility of finding the desired topic included in the book. It is expected that this collection of chapters will contribute to the state of the art in the thermodynamics area.
Deep Geologic Repositories
This volume contains 11 case studies of toxic waste repositories that use geologic isolation in order to accomplish the permanent and safe isolation of dangerous materials. It describes past and currently active facilities and also discusses generic considerations of the isolation capability of average crustal rock, apparently in an effort to convince audiences of the safety of these facilities.
Information Market Guide (I'M Guide): Commission of the European Communities
An inventory of information products and services available on the European Information Services Market. Points out the differences/advantages of the online database compared to the printed version which is in front of you.
Integrative Computational Materials Engineering
Presenting the results of an ambitious project, this book summarizes the efforts towards an open, web-based modular and extendable simulation platform for materials engineering that allows simulations bridging several length scales. In so doing, it covers processes along the entire value chain and even describes such different classes of materials as metallic alloys and polymers. It comprehensively describes all structural ideas, the underlying concepts, standard specifications, the verification results obtained for different test cases and additionally how to utilize the platform as a user and how to join it as a provider. A resource for researchers, users and simulation software providers alike, the monograph provides an overview of the current status, serves as a generic manual for prospective users, and offers insights into the inner modular structure of the simulation platform.
Materials Chemistry at High Temperatures
Conference Overview and the Role of Chemistry in High-Temperature Materials Science and Technology LEO BREWER Department of ChemistIy, University of California, and Materials and Chemical Sciences Division, Lawrence Berkeley Laboratory, 1 Cyclotron Road, Berkeley, CA 94720 I don't want to compete with the fascinating historic account that John Drowart gave us, but I would like to go through the history of high don't get the reaction that I get from temperature symposia. I hope I some of my classes when I say, "Remember when such-and-such hap pened during the War?" And I get this blank look, and one of the students will say, "I wasn't born until after the Korean War. " Neverthe less, during W...
Advances in the Science and Engineering of Casting Solidification
This collection encompasses the following four areas: (1) Solidification processing: theoretical and experimental investigations of solidification processes including castings solidification, directional solidification of alloys, electromagnetic stirring, ultrasonic cavitation, mechanical vibration, active cooling and heating, powder bed-electron beam melting additive manufacturing, etc. for processing of metals, polymers and composite materials; (2) Microstructure Evolution: theoretical and experimental studies related to microstructure evolution of materials including prediction of solidification-related defects and particle pushing/engulfment aspects; (3) Novel Casting and Molding Processes: modeling and experimental aspects including high pressure die casting, permanent casting, centrifugal casting, low pressure casting, 3D silica sand mold printing, etc.; and (4) Cast Iron: all aspects related to cast iron characterization, computational and analytical modeling, and processing.
Zentropy
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 base...
Ab initio Calculation Tutorial
This textbook covers the framework of first-principles analysis applied to materials using density functional theory (DFT). It provides a set of hands-on tutorials using the Quantum ESPRESSO package, an open-source software for DFT. The tutorials are well chosen, designed for maximum effectiveness while requiring a minimum of the reader’s time, and the book describes how the essential components are combined to create the practical applications based on the idea of modeling practical problems of materials. The book carefully explains how to prepare the platform to run the tutorials assisted by free software. This textbook is useful for students in experimental laboratories, for industrial researchers, and for those not majoring in theoretical studies but learning individually.
