First Principles Design of Non-Centrosymmetric Metal Oxides

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ISBN 13 :
Total Pages : 416 pages
Book Rating : 4.:/5 (949 download)

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Book Synopsis First Principles Design of Non-Centrosymmetric Metal Oxides by : Joshua Aaron Young

Download or read book First Principles Design of Non-Centrosymmetric Metal Oxides written by Joshua Aaron Young and published by . This book was released on 2016 with total page 416 pages. Available in PDF, EPUB and Kindle. Book excerpt: The lack of an inversion center in a material's crystal structure can result in many useful material properties, such as ferroelectricity, piezoelectricity and non-linear optical behavior. Recently, the desire for low power, high efficiency electronic devices has spurred increased interest in these phenomena, especially ferroelectricity, as well as their coupling to other material properties. By studying and understanding the fundamental structure-property relationships present in non-centrosymmetric materials, it is possible to purposefully engineer new compounds with the desired "acentric" qualities through crystal engineering. The families of ABO3 perovskite and ABO2.5 perovskite-derived brownmillerite oxides are ideal for such studies due to their wide range of possible chemistries, as well as ground states that are highly tunable owing to strong electron-lattice coupling. Furthermore, control over the B-O-B bond angles through epitaxial strain or chemical substitution allows for the rapid development of new emergent properties. In this dissertation, I formulate the crystal-chemistry criteria necessary to design functional non-centrosymmetric oxides using first-principles density functional theory calculations. Recently, chemically ordered (AA')B2O6 oxides have been shown to display a new form of rotation-induced ferroelectric polarizations. I now extend this property-design methodology to alternative compositions and crystal classes and show it is possible to induce a host of new phenomena. This dissertation will address: 1) the formulation of predictive models allowing for a priori design of polar oxides, 2) the optimization of properties exhibited by these materials through chemical substitution and cation ordering, and 3) the use of strain to control the stability of new phases. Completion of this work has led to a deeper understanding of how atomic structural features determine the physical properties of oxides, as well as the successful elucidation of new design principles to help guide experimental synthesis of novel materials.

Biomimetic Principles and Design of Advanced Engineering Materials

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Publisher : John Wiley & Sons
ISBN 13 : 1118533070
Total Pages : 317 pages
Book Rating : 4.1/5 (185 download)

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Book Synopsis Biomimetic Principles and Design of Advanced Engineering Materials by : Zhenhai Xia

Download or read book Biomimetic Principles and Design of Advanced Engineering Materials written by Zhenhai Xia and published by John Wiley & Sons. This book was released on 2016-08-29 with total page 317 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book explores the structure-property-process relationship of biomaterials from engineering and biomedical perspectives, and the potential of bio-inspired materials and their applications. A large variety of natural materials with outstanding physical and mechanical properties have appeared in the course of evolution. From a bio-inspired viewpoint, materials design requires a novel and highly cross disciplinary approach. Considerable benefits can be gained by providing an integrated approach using bio-inspiration with materials science and engineering. The book is divided into three parts; Part One focuses on mechanical aspects, dealing with conventional material properties: strength, toughness, hardness, wear resistance, impact resistance, self-healing, adhesion, and adaptation and morphing. Part Two focuses on functional materials with unique capabilities, such as self-cleaning, stimuli-response, structural color, anti-reflective materials, catalytic materials for clean energy conversion and storage, and other related topics. Part Three describes how to mimic natural materials processes to synthesize materials with low cost, efficient and environmentally friendly approaches. For each chapter, the approach is to describe situations in nature first and then biomimetic materials, fulfilling the need for an interdisciplinary approach which overlaps both engineering and materials science.

First Principles

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ISBN 13 :
Total Pages : pages
Book Rating : 4.:/5 (599 download)

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Book Synopsis First Principles by : Eric Jonathan Whitehead

Download or read book First Principles written by Eric Jonathan Whitehead and published by . This book was released on 1993 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:

Functional Metal Oxides

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Publisher : John Wiley & Sons
ISBN 13 : 3527654887
Total Pages : 478 pages
Book Rating : 4.5/5 (276 download)

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Book Synopsis Functional Metal Oxides by : Satishchandra Balkrishna Ogale

Download or read book Functional Metal Oxides written by Satishchandra Balkrishna Ogale and published by John Wiley & Sons. This book was released on 2013-11-08 with total page 478 pages. Available in PDF, EPUB and Kindle. Book excerpt: Functional oxides are used both as insulators and metallic conductors in key applications across all industrial sectors. This makes them attractive candidates in modern technology ? they make solar cells cheaper, computers more efficient and medical instrumentation more sensitive. Based on recent research, experts in the field describe novel materials, their properties and applications for energy systems, semiconductors, electronics, catalysts and thin films. This monograph is divided into 6 parts which allows the reader to find their topic of interest quickly and efficiently. * Magnetic Oxides * Dopants, Defects and Ferromagnetism in Metal Oxides * Ferroelectrics * Multiferroics * Interfaces and Magnetism * Devices and Applications This book is a valuable asset to materials scientists, solid state chemists, solid state physicists, as well as engineers in the electric and automotive industries.

First-principles Studies of the Low Dimensional Transition Metal Oxides

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ISBN 13 :
Total Pages : 80 pages
Book Rating : 4.:/5 (132 download)

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Book Synopsis First-principles Studies of the Low Dimensional Transition Metal Oxides by : Jiao An

Download or read book First-principles Studies of the Low Dimensional Transition Metal Oxides written by Jiao An and published by . This book was released on 2020 with total page 80 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Topological Semimetals

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Publisher : Materials Research Forum LLC
ISBN 13 : 1644900157
Total Pages : 164 pages
Book Rating : 4.6/5 (449 download)

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Book Synopsis Topological Semimetals by : David J. Fisher

Download or read book Topological Semimetals written by David J. Fisher and published by Materials Research Forum LLC. This book was released on 2019-04-20 with total page 164 pages. Available in PDF, EPUB and Kindle. Book excerpt: Topological semimetals are quantum materials that are not only extremely interesting from a theoretical point of view but also have a great potential for technological applications in which superconducting, semiconducting and other semimetal behaviors are involved. Keywords: Quantum Materials, Macroscopic Quantum Phenomena, Topological Semimetals, Dirac Semimetals, Weyl Semimetals, Nodal-Line Semimetals, Antimony and Antimonides, Antimonene, Arsenides, Bismuthides, Boron, Borides, Borophene, Carbon and Carbides, Chalcogenides, Nitrides, Phosphorus, Phosphides, Silicides, Topological Metals, Topological States of Matter.

First-principles Study of Excitation on Transition Metal Oxides by Linear Response Method

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ISBN 13 :
Total Pages : 234 pages
Book Rating : 4.:/5 (496 download)

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Book Synopsis First-principles Study of Excitation on Transition Metal Oxides by Linear Response Method by : Chi-Cheng Lee

Download or read book First-principles Study of Excitation on Transition Metal Oxides by Linear Response Method written by Chi-Cheng Lee and published by . This book was released on 2007 with total page 234 pages. Available in PDF, EPUB and Kindle. Book excerpt:

First Principles Studies of Oxide Surface Defects and Metal-oxide Interfaces

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ISBN 13 :
Total Pages : 144 pages
Book Rating : 4.:/5 (14 download)

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Book Synopsis First Principles Studies of Oxide Surface Defects and Metal-oxide Interfaces by : Davide Ricci

Download or read book First Principles Studies of Oxide Surface Defects and Metal-oxide Interfaces written by Davide Ricci and published by . This book was released on 2004 with total page 144 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Thermodynamic Investigation of Transition Metal Oxides Via CALPHAD and First-principles Methods

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ISBN 13 :
Total Pages : 97 pages
Book Rating : 4.:/5 (862 download)

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Book Synopsis Thermodynamic Investigation of Transition Metal Oxides Via CALPHAD and First-principles Methods by : Lei Zhang

Download or read book Thermodynamic Investigation of Transition Metal Oxides Via CALPHAD and First-principles Methods written by Lei Zhang and published by . This book was released on 2013 with total page 97 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Physics Briefs

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ISBN 13 :
Total Pages : 968 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis Physics Briefs by :

Download or read book Physics Briefs written by and published by . This book was released on 1993 with total page 968 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Ceramic Abstracts

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ISBN 13 :
Total Pages : 254 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis Ceramic Abstracts by :

Download or read book Ceramic Abstracts written by and published by . This book was released on 2001 with total page 254 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Zeitschrift Für Kristallographie

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Publisher :
ISBN 13 :
Total Pages : 600 pages
Book Rating : 4.:/5 (318 download)

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Book Synopsis Zeitschrift Für Kristallographie by :

Download or read book Zeitschrift Für Kristallographie written by and published by . This book was released on 2005 with total page 600 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Metal-Organic Frameworks

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Publisher : John Wiley & Sons
ISBN 13 : 111803516X
Total Pages : 440 pages
Book Rating : 4.1/5 (18 download)

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Book Synopsis Metal-Organic Frameworks by : Leonard R. MacGillivray

Download or read book Metal-Organic Frameworks written by Leonard R. MacGillivray and published by John Wiley & Sons. This book was released on 2010-12-17 with total page 440 pages. Available in PDF, EPUB and Kindle. Book excerpt: Metal-organic frameworks represent a new class of materials that may solve the hydrogen storage problem associated with hydrogen-fueled vehicles. In this first definitive guide to metal-organic framework chemistry, author L. MacGillivray addresses state-of-art developments in this promising technology for alternative fuels. Providing professors, graduate and undergraduate students, structural chemists, physical chemists, and chemical engineers with a historical perspective, as well as the most up-to-date developments by leading experts, Metal-Organic Frameworks examines structure, symmetry, supramolecular chemistry, surface engineering, metal-organometallic frameworks, properties, and reactions.

Nanoscience And Technology: A Collection Of Reviews From Nature Journals

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Publisher : World Scientific
ISBN 13 : 9814466867
Total Pages : 367 pages
Book Rating : 4.8/5 (144 download)

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Book Synopsis Nanoscience And Technology: A Collection Of Reviews From Nature Journals by : Peter Rodgers

Download or read book Nanoscience And Technology: A Collection Of Reviews From Nature Journals written by Peter Rodgers and published by World Scientific. This book was released on 2009-08-21 with total page 367 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book contains 35 review articles on nanoscience and nanotechnology that were first published in Nature Nanotechnology, Nature Materials and a number of other Nature journals. The articles are all written by leading authorities in their field and cover a wide range of areas in nanoscience and technology, from basic research (such as single-molecule devices and new materials) through to applications (in, for example, nanomedicine and data storage).

Nonlinear Optical Materials

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Publisher : Springer Science & Business Media
ISBN 13 : 9780387985817
Total Pages : 270 pages
Book Rating : 4.9/5 (858 download)

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Book Synopsis Nonlinear Optical Materials by : Jerome V. Moloney

Download or read book Nonlinear Optical Materials written by Jerome V. Moloney and published by Springer Science & Business Media. This book was released on 1998-08-13 with total page 270 pages. Available in PDF, EPUB and Kindle. Book excerpt: Mathematical methods play a significant role in the rapidly growing field of nonlinear optical materials. This volume discusses a number of successful or promising contributions. The overall theme of this volume is twofold: (1) the challenges faced in computing and optimizing nonlinear optical material properties; and (2) the exploitation of these properties in important areas of application. These include the design of optical amplifiers and lasers, as well as novel optical switches. Research topics in this volume include how to exploit the magnetooptic effect, how to work with the nonlinear optical response of materials, how to predict laser-induced breakdown in efficient optical devices, and how to handle electron cloud distortion in femtosecond processes.

Geometry, Topology and Physics

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Publisher : Taylor & Francis
ISBN 13 : 1420056948
Total Pages : 596 pages
Book Rating : 4.4/5 (2 download)

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Book Synopsis Geometry, Topology and Physics by : Mikio Nakahara

Download or read book Geometry, Topology and Physics written by Mikio Nakahara and published by Taylor & Francis. This book was released on 2018-10-03 with total page 596 pages. Available in PDF, EPUB and Kindle. Book excerpt: Differential geometry and topology have become essential tools for many theoretical physicists. In particular, they are indispensable in theoretical studies of condensed matter physics, gravity, and particle physics. Geometry, Topology and Physics, Second Edition introduces the ideas and techniques of differential geometry and topology at a level suitable for postgraduate students and researchers in these fields. The second edition of this popular and established text incorporates a number of changes designed to meet the needs of the reader and reflect the development of the subject. The book features a considerably expanded first chapter, reviewing aspects of path integral quantization and gauge theories. Chapter 2 introduces the mathematical concepts of maps, vector spaces, and topology. The following chapters focus on more elaborate concepts in geometry and topology and discuss the application of these concepts to liquid crystals, superfluid helium, general relativity, and bosonic string theory. Later chapters unify geometry and topology, exploring fiber bundles, characteristic classes, and index theorems. New to this second edition is the proof of the index theorem in terms of supersymmetric quantum mechanics. The final two chapters are devoted to the most fascinating applications of geometry and topology in contemporary physics, namely the study of anomalies in gauge field theories and the analysis of Polakov's bosonic string theory from the geometrical point of view. Geometry, Topology and Physics, Second Edition is an ideal introduction to differential geometry and topology for postgraduate students and researchers in theoretical and mathematical physics.

The Defect Chemistry of Metal Oxides

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Publisher : Oxford University Press on Demand
ISBN 13 : 9780195110142
Total Pages : 294 pages
Book Rating : 4.1/5 (11 download)

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Book Synopsis The Defect Chemistry of Metal Oxides by : Donald Morgan Smyth

Download or read book The Defect Chemistry of Metal Oxides written by Donald Morgan Smyth and published by Oxford University Press on Demand. This book was released on 2000 with total page 294 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Defect Chemistry of Metal Oxides is a unique introduction to the equilibrium chemistry of solid inorganic compounds with a focus on metal oxides. Accessible to students with little or no background in defect chemistry, it explains how to apply basic principles and interpret the related behavior of materials. Topics discussed include lattice and electronic defects, doping effects, nonstoichiometry, and mass and charge transport. The text distinctly emphasizes the correlation between the general chemical properties of the constituent elements and the defect chemistry and transport properties of their compounds. It covers the types of defects formed, the effects of dopants, the amount and direction of nonstoichiometry, the depths of acceptor and donor levels, and more. Concluding chapters present up-to-date and detailed analyses of three systems: titanium dioxide, cobalt oxide and nickel oxide, and barium titanate. The Defect Chemistry of Metal Oxides is the only book of its kind that incorporates sample problems for students to solve. Suitable for a variety of courses in materials science and engineering, chemistry, and geochemistry, it also serves as a valuable reference for researchers and instructors.