Theory and Application of Quantum-based Interatomic Potentials in Metals and Alloys

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ISBN 13 : 9780191861222
Total Pages : 0 pages
Book Rating : 4.8/5 (612 download)

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Book Synopsis Theory and Application of Quantum-based Interatomic Potentials in Metals and Alloys by : John A. Moriarty

Download or read book Theory and Application of Quantum-based Interatomic Potentials in Metals and Alloys written by John A. Moriarty and published by . This book was released on 2023 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book spans the entire QBIP process from foundation in fundamental theory, to development and machine-learning optimization of accurate potentials for real materials, to the application of the potentials to materials modeling and simulation of structural, thermodynamic, defect and mechanical properties of important metals and alloys.

Theory and Application of Quantum-Based Interatomic Potentials in Metals and Alloys

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Publisher : Oxford University Press
ISBN 13 : 0192555359
Total Pages : 593 pages
Book Rating : 4.1/5 (925 download)

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Book Synopsis Theory and Application of Quantum-Based Interatomic Potentials in Metals and Alloys by : John A. Moriarty

Download or read book Theory and Application of Quantum-Based Interatomic Potentials in Metals and Alloys written by John A. Moriarty and published by Oxford University Press. This book was released on 2023-08-15 with total page 593 pages. Available in PDF, EPUB and Kindle. Book excerpt: Atomistic computer simulations are often at the heart of modern attempts to predict and understand the physical properties of real materials, including the vast domain of metals and alloys. Historically, highly simplified empirical potentials have been used to provide the interatomic forces needed to perform such simulations, but true predictive power in these materials emanates from fundamental quantum mechanics. In metals and alloys especially, a viable path forward to the vastly larger length and time scales offered by empirical potentials, while retaining the predictive power of quantum mechanics, is to course-grain the underlying electronic structure of the material and systematically derive quantum-based interatomic potentials from first-principles. This book spans the entire process from foundation in fundamental theory, to the development of accurate quantum-based potentials for real materials, to the wide-spread application of the potentials to the atomistic simulation of structural, thermodynamic, defect and mechanical properties of metals and alloys.

Bimetallic Nanostructures

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Publisher : John Wiley & Sons
ISBN 13 : 1119214645
Total Pages : 521 pages
Book Rating : 4.1/5 (192 download)

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Book Synopsis Bimetallic Nanostructures by : Ya-Wen Zhang

Download or read book Bimetallic Nanostructures written by Ya-Wen Zhang and published by John Wiley & Sons. This book was released on 2018-08-06 with total page 521 pages. Available in PDF, EPUB and Kindle. Book excerpt: Systematically summarizes the current status and recent advances in bimetallic structures, their shape-controlled synthesis, properties, and applications Intensive researches are currently being carried out on bimetallic nanostructures, focusing on a number of fundamental, physical, and chemical questions regarding their synthesis and properties. This book presents a systematic and comprehensive summary of the current status and recent advances in this field, supporting readers in the synthesis of model bimetallic nanoparticles, and the exploration and interpretation of their properties. Bimetallic Nanostructures: Shape-Controlled Synthesis for Catalysis, Plasmonics and Sensing Applications is divided into three parts. Part 1 introduces basic chemical and physical knowledge of bimetallic structures, including fundamentals, computational models, and in situ characterization techniques. Part 2 summarizes recent developments in synthetic methods, characterization, and properties of bimetallic structures from the perspective of morphology effect, including zero-dimensional nanomaterials, one-dimensional nanomaterials, and two-dimensional nanomaterials. Part 3 discusses applications in electrocatalysis, heterogeneous catalysis, plasmonics and sensing. Comprehensive reference for an important multidisciplinary research field Thoroughly summarizes the present state and latest developments in bimetallic structures Helps researchers find optimal synthetic methods and explore new phenomena in surface science and synthetic chemistry of bimetallic nanostructures Bimetallic Nanostructures: Shape-Controlled Synthesis for Catalysis, Plasmonics and Sensing Applications is an excellent source or reference for researchers and advanced students. Academic researchers in nanoscience, nanocatalysis, and surface plasmonics, and those working in industry in areas involving nanotechnology, catalysis and optoelectronics, will find this book of interest.

Scientific and Technical Aerospace Reports

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Publisher :
ISBN 13 :
Total Pages : 1460 pages
Book Rating : 4.:/5 (31 download)

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Book Synopsis Scientific and Technical Aerospace Reports by :

Download or read book Scientific and Technical Aerospace Reports written by and published by . This book was released on 1991 with total page 1460 pages. Available in PDF, EPUB and Kindle. Book excerpt: Lists citations with abstracts for aerospace related reports obtained from world wide sources and announces documents that have recently been entered into the NASA Scientific and Technical Information Database.

International Conference on Metals in Solution

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Publisher :
ISBN 13 :
Total Pages : 412 pages
Book Rating : 4.:/5 (42 download)

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Book Synopsis International Conference on Metals in Solution by : Pierre Damay

Download or read book International Conference on Metals in Solution written by Pierre Damay and published by . This book was released on 1991 with total page 412 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Modeling, Characterization, and Production of Nanomaterials

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Publisher : Woodhead Publishing
ISBN 13 : 0128199199
Total Pages : 628 pages
Book Rating : 4.1/5 (281 download)

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Book Synopsis Modeling, Characterization, and Production of Nanomaterials by : Vinod Tewary

Download or read book Modeling, Characterization, and Production of Nanomaterials written by Vinod Tewary and published by Woodhead Publishing. This book was released on 2022-11-09 with total page 628 pages. Available in PDF, EPUB and Kindle. Book excerpt: Nano-scale materials have unique electronic, optical, and chemical properties that make them attractive for a new generation of devices. In the second edition of Modeling, Characterization, and Production of Nanomaterials: Electronics, Photonics, and Energy Applications, leading experts review the latest advances in research in the understanding, prediction, and methods of production of current and emerging nanomaterials for key applications. The chapters in the first half of the book cover applications of different modeling techniques, such as Green’s function-based multiscale modeling and density functional theory, to simulate nanomaterials and their structures, properties, and devices. The chapters in the second half describe the characterization of nanomaterials using advanced material characterization techniques, such as high-resolution electron microscopy, near-field scanning microwave microscopy, confocal micro-Raman spectroscopy, thermal analysis of nanoparticles, and applications of nanomaterials in areas such as electronics, solar energy, catalysis, and sensing. The second edition includes emerging relevant nanomaterials, applications, and updated modeling and characterization techniques and new understanding of nanomaterials. Covers the close connection between modeling and experimental methods for studying a wide range of nanomaterials and nanostructures Focuses on practical applications and industry needs through a solid outlining of the theoretical background Includes emerging nanomaterials and their applications in spintronics and sensing

SciDAC 2007

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Publisher :
ISBN 13 :
Total Pages : 1396 pages
Book Rating : 4.E/5 ( download)

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Book Synopsis SciDAC 2007 by :

Download or read book SciDAC 2007 written by and published by . This book was released on 2007 with total page 1396 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Latest Developments in the Field of Magnesium Alloys and their Applications

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Publisher : Frontiers Media SA
ISBN 13 : 2889712842
Total Pages : 192 pages
Book Rating : 4.8/5 (897 download)

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Book Synopsis Latest Developments in the Field of Magnesium Alloys and their Applications by : Hajo Dieringa

Download or read book Latest Developments in the Field of Magnesium Alloys and their Applications written by Hajo Dieringa and published by Frontiers Media SA. This book was released on 2021-09-13 with total page 192 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Energy Research Abstracts

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Publisher :
ISBN 13 :
Total Pages : 1686 pages
Book Rating : 4.U/5 (183 download)

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Book Synopsis Energy Research Abstracts by :

Download or read book Energy Research Abstracts written by and published by . This book was released on 1988 with total page 1686 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Concise Encyclopedia of Semiconducting Materials & Related Technologies

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Publisher : Elsevier
ISBN 13 : 1483286576
Total Pages : 607 pages
Book Rating : 4.4/5 (832 download)

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Book Synopsis Concise Encyclopedia of Semiconducting Materials & Related Technologies by : S. Mahajan

Download or read book Concise Encyclopedia of Semiconducting Materials & Related Technologies written by S. Mahajan and published by Elsevier. This book was released on 2013-10-22 with total page 607 pages. Available in PDF, EPUB and Kindle. Book excerpt: The development of electronic materials and particularly advances in semiconductor technology have played a central role in the electronics revolution by allowing the production of increasingly cheap and powerful computing equipment and advanced telecommunications devices. This Concise Encyclopedia, which incorporates relevant articles from the acclaimed Encyclopedia of Materials Science and Engineering as well as newly commissioned articles, emphasizes the materials aspects of semiconductors and the technologies important in solid-state electronics. Growth of bulk crystals and epitaxial layers are discussed in the volume and coverage is included of defects and their effects on device behavior. Metallization and passivation issues are also covered. Over 100 alphabetically arranged articles, written by world experts in the field, are each intended to serve as the first source of information on a particular aspect of electronic materials. The volume is extensively illustrated with photographs, diagrams and tables. A bibliography is provided at the end of each article to guide the reader to recent literature. A comprehensive system of cross-references, a three-level subject index and an alphabetical list of articles are included to aid readers in the abstraction of information.

Chemical Abstracts

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ISBN 13 :
Total Pages : 2540 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis Chemical Abstracts by :

Download or read book Chemical Abstracts written by and published by . This book was released on 2002 with total page 2540 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Superalloys 2012

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Publisher : John Wiley & Sons
ISBN 13 : 1118516400
Total Pages : 952 pages
Book Rating : 4.1/5 (185 download)

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Book Synopsis Superalloys 2012 by : Eric S. Huron

Download or read book Superalloys 2012 written by Eric S. Huron and published by John Wiley & Sons. This book was released on 2012-10-02 with total page 952 pages. Available in PDF, EPUB and Kindle. Book excerpt: A superalloy, or high-performance alloy, is an alloy that exhibits excellent mechanical strength at high temperatures. Superalloy development has been driven primarily by the aerospace and power industries. This compilation of papers from the Twelfth International Symposium on Superalloys, held from September 9-13, 2012, offers the most recent technical information on this class of materials.

Treatise on Process Metallurgy

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Publisher : Elsevier
ISBN 13 : 0323859607
Total Pages : 818 pages
Book Rating : 4.3/5 (238 download)

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Book Synopsis Treatise on Process Metallurgy by : Roderick Guthrie

Download or read book Treatise on Process Metallurgy written by Roderick Guthrie and published by Elsevier. This book was released on 2024-01-25 with total page 818 pages. Available in PDF, EPUB and Kindle. Book excerpt: Treatise on Process Metallurgy: Volume One, Process Fundamentals provides academics with the fundamentals of the manufacturing of metallic materials, from raw materials into finished parts or products. In these fully updated volumes, coverage is expanded into four volumes, including Process Fundamentals, encompassing process fundamentals, structure and properties of matter; thermodynamic aspects of process metallurgy, and rate phenomena in process metallurgy; Processing Phenomena, encompassing interfacial phenomena in high temperature metallurgy, metallurgical process phenomena, and metallurgical process technology; Metallurgical Processes, encompassing mineral processing, aqueous processing, electrochemical material and energy processes, and iron and steel technology, non-ferrous process principles and production technologies, and more. The work distills the combined academic experience from the principal editor and the multidisciplinary four-member editorial board. Provides the entire breadth of process metallurgy in a single work Includes in-depth knowledge in all key areas of process metallurgy Approaches the topic from an interdisciplinary perspective, providing broad range coverage on topics

Liquids

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Publisher :
ISBN 13 :
Total Pages : 932 pages
Book Rating : 4.:/5 (41 download)

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Book Synopsis Liquids by :

Download or read book Liquids written by and published by . This book was released on 1991 with total page 932 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Choice

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Publisher :
ISBN 13 :
Total Pages : 344 pages
Book Rating : 4.:/5 (321 download)

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Book Synopsis Choice by :

Download or read book Choice written by and published by . This book was released on 1973 with total page 344 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Zentralblatt für Mineralogie

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Publisher :
ISBN 13 :
Total Pages : 248 pages
Book Rating : 4.:/5 (318 download)

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Book Synopsis Zentralblatt für Mineralogie by :

Download or read book Zentralblatt für Mineralogie written by and published by . This book was released on 1992 with total page 248 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Metastable Alloys

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Publisher : North Holland
ISBN 13 :
Total Pages : 684 pages
Book Rating : 4.0/5 ( download)

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Book Synopsis Metastable Alloys by : K. Samwer

Download or read book Metastable Alloys written by K. Samwer and published by North Holland. This book was released on 1989 with total page 684 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains most of the papers presented at symposium D, one of the four symposia that formed the 1988 Strasbourg Spring Conference. The three day programme consisted of nine oral sessions; a poster session and a plenary talk giving an overview of current topics in hard magnetic materials. Scientists involved in basic as well as applied research concentrated their discussions on the fundamental processes relevant for the formation of metastable alloys such as amorphous alloys (metallic glasses), microcrystalline, quasicrystalline and nanocrystalline alloys and their applications. These materials are proving to be of considerable interest to research workers because of their possible application in the electronics industry, e.g. as diffusion barriers in devices or as data storage media.