Integrated Quantum Mechanical Approach To Stability Chemical Order And Phase Evolution In Complex Alloys
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High-Entropy Alloys
Author | : Michael C. Gao |
Publisher | : Springer |
Total Pages | : 524 |
Release | : 2016-04-27 |
Genre | : Technology & Engineering |
ISBN | : 3319270133 |
This book provides a systematic and comprehensive description of high-entropy alloys (HEAs). The authors summarize key properties of HEAs from the perspective of both fundamental understanding and applications, which are supported by in-depth analyses. The book also contains computational modeling in tackling HEAs, which help elucidate the formation mechanisms and properties of HEAs from various length and time scales.
Complex Concentrated Alloys (CCAs)
Author | : Sundeep Mukherjee |
Publisher | : MDPI |
Total Pages | : 278 |
Release | : 2020-11-04 |
Genre | : Technology & Engineering |
ISBN | : 3039434748 |
This book is a collection of several unique articles on the current state of research on complex concentrated alloys, as well as their compelling future opportunities in wide ranging applications. Complex concentrated alloys consist of multiple principal elements and represent a new paradigm in structural alloy design. They show a range of exceptional properties that are unachievable in conventional alloys, including high strength–ductility combination, resistance to oxidation, corrosion/wear resistance, and excellent high-temperature properties. The research articles, reviews, and perspectives are intended to provide a wholistic view of this multidisciplinary subject of interest to scientists and engineers.
Computational Quantum Mechanics for Materials Engineers
Author | : Levente Vitos |
Publisher | : Springer Science & Business Media |
Total Pages | : 237 |
Release | : 2007-08-10 |
Genre | : Technology & Engineering |
ISBN | : 1846289513 |
This is the only book to cover the most recent developments in applied quantum theory and their use in modeling materials properties. It describes new approaches to modeling disordered alloys and focuses on those approaches that combine the most efficient quantum-level theories of random alloys with the most sophisticated numerical techniques. In doing so, it establishes a theoretical insight into the electronic structure of complex materials such as stainless steels, Hume-Rothery alloys and silicates.
XAFS Techniques for Catalysts, Nanomaterials, and Surfaces
Author | : Yasuhiro Iwasawa |
Publisher | : Springer |
Total Pages | : 545 |
Release | : 2016-10-19 |
Genre | : Science |
ISBN | : 3319438662 |
This book is a comprehensive, theoretical, practical, and thorough guide to XAFS spectroscopy. The book addresses XAFS fundamentals such as experiments, theory and data analysis, advanced XAFS methods such as operando XAFS, time-resolved XAFS, spatially resolved XAFS, total-reflection XAFS, high energy resolution XAFS, and practical applications to a variety of catalysts, nanomaterials and surfaces. This book is accessible to a broad audience in academia and industry, and will be a useful guide for researchers entering the subject and graduate students in a wide variety of disciplines.
Phase-Field Methods in Materials Science and Engineering
Author | : Nikolas Provatas |
Publisher | : John Wiley & Sons |
Total Pages | : 323 |
Release | : 2011-07-26 |
Genre | : Computers |
ISBN | : 3527632379 |
This comprehensive and self-contained, one-stop source discusses phase-field methodology in a fundamental way, explaining advanced numerical techniques for solving phase-field and related continuum-field models. It also presents numerical techniques used to simulate various phenomena in a detailed, step-by-step way, such that readers can carry out their own code developments. Features many examples of how the methods explained can be used in materials science and engineering applications.
Computational Thermodynamics
Author | : H. L. Lukas |
Publisher | : |
Total Pages | : 342 |
Release | : 2007-07-12 |
Genre | : Mathematics |
ISBN | : |
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.
Statics and Dynamics of Alloy Phase Transformations
Author | : Patrice E. A. Turchi |
Publisher | : Springer Science & Business Media |
Total Pages | : 764 |
Release | : 1994 |
Genre | : Science |
ISBN | : 9780306446269 |
The proceedings of the NATO Advanced Study Institute on title], held in Rhodes, Greece, June-July 1992, comprise invited and contributed papers that focus on recent experimental, theoretical, and computational developments in the study of phase alloy transformations. The coverage is in three parts:
Thermochemistry of Alloys
Author | : H. Brodowsky |
Publisher | : Springer Science & Business Media |
Total Pages | : 579 |
Release | : 2012-12-06 |
Genre | : Technology & Engineering |
ISBN | : 9400910274 |
The thermochemistry of alloys has interested generations of scientists and the subject was treated in classical textbooks long ago, e.g. by Hume-Rothery, by Wagner, and by Kubaschewski and Alcock. Nevertheless, the appearance of new materials and the desire to improve traditional materials and metallurgical processes has kept up demand for more information on the thermodynamics of these systems. The advent of computing power has created new opportunities to tie various aspects and properties together, such as phase diagrams and thermodynamic functions, that are in principle thermodynamically inter related but were too cumbersome to work out before. The computer has also been a powerful tool in buUding and testing models that help to explain the underlying causes of non-ideal behavior. At the same time, these calculations have pinpointed areas, where additional and more accurate data are needed. In the laboratory, new methods, improved materials, and sophistica ted instrumentation have gradually changed the way in which experiments are done. Within the time span of perhaps thirty years, the development went from jotting down individual readings of data points to strip chart recording to automatic digital data acquisition. Scholars and students active in the field of "Thermochemistry of Alloys" convened for a NATO Advanced Study Institute at Kiel in August 1987 to discuss these developments. This book collects most of the lectures and seminar papers given at the Institute.