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First Principles Approaches To Metals Alloys And Metallic Compounds


First Principles Approaches To Metals Alloys And Metallic Compounds
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First Principles Approaches To Metals Alloys And Metallic Compounds


First Principles Approaches To Metals Alloys And Metallic Compounds
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Author : Richard Dronskowski
language : en
Publisher: MDPI
Release Date : 2018-11-26

First Principles Approaches To Metals Alloys And Metallic Compounds written by Richard Dronskowski and has been published by MDPI this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-11-26 with Electronic books categories.


(This book is a printed edition of the Special Issue "First-Principles Approaches to Metals, Alloys, and Metallic Compounds" that was published in Metals



First Principles Approaches To Metals Alloys And Metallic Compounds


First Principles Approaches To Metals Alloys And Metallic Compounds
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Author : Richard Dronskowski
language : en
Publisher:
Release Date : 2018

First Principles Approaches To Metals Alloys And Metallic Compounds written by Richard Dronskowski and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018 with categories.




Superconductivity In D And F Band Metals


Superconductivity In D And F Band Metals
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Author : D. Douglass
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06

Superconductivity In D And F Band Metals written by D. Douglass and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Technology & Engineering categories.


The occurrence of superconductivity among the d- and f-band metals remains one of the unsolved problems of physics. The first Rochester conference on this subject in October 1971 brought together approximately 100 experimentalists and theorists, and that conference was considered successful; the published proceedings well-represented the current research at that time and has served as a "handbook" to many. In the four and one half years since the first conference, impressive progress has been made in many areas (although Berndt Matthias would be one of the first to point out that raising the m"aximum transition temperature by a significant amount was not one of them). For a variety of reasons, I decided that it was time for a Second Rochester Conference on Superconductivity in d- and f-Band Metals and it was held on April 30 and May 1, 1976. It would appear that this conference was even more successful judging from the quality of the talks and various comments made to me. I believe that this was due to the fact that the subject matter is exciting and that the timing was particularly appropriate for several areas of research that were discussed. However, I cannot rule out other factors such as the one advanced humorously by J.



Density Functional Theory


Density Functional Theory
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Author : Sajjad Haider
language : en
Publisher: BoD – Books on Demand
Release Date : 2024-01-24

Density Functional Theory written by Sajjad Haider and has been published by BoD – Books on Demand this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-01-24 with Science categories.


This book presents a comprehensive overview of density functional theory (DFT), from its basics to its practical application and implementation. It also discusses the breakthroughs in the field and the complete integration of physical and chemical aspects. It examines both orbital and time-dependent functions along with their variations according to semiquantitative analysis. The book also discusses analytical and computational techniques and principles, considering the classical and quantum approaches. Also covered are important topics such as HOMO (highest occupied molecular orbital), LUMO (lowest unoccupied molecular orbital), MEP (minimum energy paths), KS-DFT (Kohn-Sham density functional theory), UHFD (Unrestricted Hartree-Fock-Dirac), and Gaussian methods.



Amorphous Metallic Alloys


Amorphous Metallic Alloys
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Author : BURTON
language : en
Publisher: Elsevier
Release Date : 2013-10-22

Amorphous Metallic Alloys written by BURTON and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-10-22 with Technology & Engineering categories.


Amorphous Metallic Alloys covers the preparation and properties of alloys produced by rapid quenching from the molten state. This book focuses on three technologically important classes of magnetic amorphous alloy—transition metal-metalloid (TM-M) alloys, rare earth-transition metal (RE-TM) alloys, and transition metal-zirconium or hafnium alloys (TM-Zr-Hf). The melt-quenched transition metal-metalloid and transition metal-zirconium type alloys are also emphasized. This text likewise explains in detail how amorphous atomic structure affects magnetic, mechanical, chemical, corrosion, and electrical characteristics. Other topics include glass forming ability in metallic materials, scattering theory of amorphous metals, dynamics of inhomogeneous plastic flow, and powder production processes. This publication is intended for students and researchers conducting work on amorphous metallic alloys.



Structural And Phase Stability Of Alloys


Structural And Phase Stability Of Alloys
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Author : J. L. Morán-López
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06

Structural And Phase Stability Of Alloys written by J. L. Morán-López and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Technology & Engineering categories.


This vohune contains the papers presented at the Adriatico Research Conference on Structural and Phase Stability of Alloys held in Trieste, Italy, in May 1991, under the auspices of the International Centre for Theoretical Physics. The conference brought together participants with a variety of interests in theoretical and experimental aspects of alloys from Argentina, Belgium, Bulgaria, Czechslovakia, France, Germany, Italy, Japan, Mexico, People's Republic of Congo,Portugal, Switzerland, United Kingdom, United States, U. S. S. R. , and Venezuela. The conference was purposely designed to succinctly cover experimental and the oretical aspects of magnetic and non-magnetic alloys, surfaces, thin films and nanos tructures. The Conference opened with an overview of a select class of advanced structural materials, with a potential in engineering applications, for which the con ventional "physics" approach, both theoretical and experimental, should have a sig nificant impact. A number of papers were dedicated to the use of phenomenological approaches for the description of thermodynamic bulk and surface properties. It was clear from these presentations that the phenomenological models and simulations in alloy theory have reached a high degree of sophistication. Although with somewhat limited predictive powers, the phenomenological models provide a valuable tool for the understanding of a variety of subtle phenomena such as short-range order, phase stability, kinetics and the thermodynamics of surfaces and antiphase boundaries, to name a few.



Energy Research Abstracts


Energy Research Abstracts
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Author :
language : en
Publisher:
Release Date : 1992

Energy Research Abstracts written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1992 with Power resources categories.




Oecd Series On Testing And Assessment Guidance On Selecting A Strategy For Assessing The Ecological Risk Of Organometallic And Organic Metal Salt Substances Based On Their Environmental Fate


Oecd Series On Testing And Assessment Guidance On Selecting A Strategy For Assessing The Ecological Risk Of Organometallic And Organic Metal Salt Substances Based On Their Environmental Fate
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Author : OECD
language : en
Publisher: OECD Publishing
Release Date : 2017-04-13

Oecd Series On Testing And Assessment Guidance On Selecting A Strategy For Assessing The Ecological Risk Of Organometallic And Organic Metal Salt Substances Based On Their Environmental Fate written by OECD and has been published by OECD Publishing this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-04-13 with categories.


In this document a strategy is presented to facilitate the ecological risk assessment of organometallic compounds (OM) and organic metal salts (OMS), outlining key steps that are based on elucidation of the fate of these substances in the environment. This document puts forth the recommendation ...



Interatomic Potential And Structural Stability


Interatomic Potential And Structural Stability
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Author : Kiyoyuki Terakura
language : en
Publisher: Springer Science & Business Media
Release Date : 2013-03-08

Interatomic Potential And Structural Stability written by Kiyoyuki Terakura and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-03-08 with Technology & Engineering categories.


Structural stability is of fundamental importance in materials science. Up-to-date information on the theoretical aspects of phase stability of materials is contained in this volume. Most of the first-principles calculations are based on the local-density approximation (LDA). In contrast, this volume contains very recent results of "going beyond LDA", such as the density gradient expansion and the quantum Monte-Carlomethod. Following the recently introduced theoretical methods for the calculation of interatomic potentials, forces acting on atoms and total energies such as the Car-Parrinello, the effective-medium and the bond-ordermethod, attempts have been made to develop even more sophisticated methods such as the order-N method in electronic-structure calculations. The present status of these methods and their application to real systems are described. In addition, in order to study the phase stability atfinite temperatures, the microscopic calculations have to be combined with statistical treatment of the systems to describe, e.g. order-disorder transitions on the Si(001) surface or alloy phase diagrams. This book contains examples for this type of calculations.



Materials Properties And Protection


Materials Properties And Protection
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Author : Oleksandr Vasiliev
language : en
Publisher: Trans Tech Publications Ltd
Release Date : 2024-02-06

Materials Properties And Protection written by Oleksandr Vasiliev and has been published by Trans Tech Publications Ltd this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-02-06 with Science categories.


Special topic volume with invited peer-reviewed papers only