computational materials science

Materials Design Using Computational Intelligence Techniques【電子書籍】 Shubhabrata DattaThe Art of High Performance Computing for Computational Science, Vol. 2 Advanced Techniques and Examples for Materials Science【電子書籍】Theory and Simulation in Physics for Materials Applications Cutting-Edge Techniques in Theoretical and Computational Materials Science【電子書籍】Handbook Of Porphyrin Science: With Applications To Chemistry, Physics, Materials Science, Engineering, Biology And Medicine - Volume 45: Phthalocyanine Synthesis And Computational Design Of Functional Tetrapyrroles【電子書籍】 Karl M KadishFiber-Reinforced Composite Materials Characterization and Computational Predictions of Mechanical Performance【電子書籍】 V. TuninettiComputational and Experimental Approaches in Materials Science and Engineering Proceedings of the International Conference of Experimental and Numerical Investigations and New Technologies, CNNTech 2019【電子書籍】Army Research Laboratory (ARL) Science and Technology Campaign Plans 2015-2035 - Computational Sciences, Materials, Maneuver, Information Sciences, Lethality and Protection, Human Sciences, Analysis【電子書籍】 Progressive ManagementIntroduction to Computational Materials Science Fundamentals to Applications【電子書籍】 Richard LeSarComputational Materials Science From Ab Initio to Monte Carlo Methods【電子書籍】 Kaoru OhnoComputational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile In Honor of William A. Goddard’s Contributions to Science and Engineering【電子書籍】Computational Materials Science An Introduction, Second Edition【電子書籍】 June Gunn LeeComputational Materials Discovery【電子書籍】Advanced Computational Methods in Mechanical and Materials Engineering【電子書籍】Computational Thermo-Fluid Dynamics In Materials Science and Engineering【電子書籍】 Petr A. NikrityukComputational Mechanics of Arbitrarily Shaped Granular Materials COMPUTATIONAL MECHANICS OF ARB (Springer Tracts in Mechanical Engineering) Siqiang WangComputational Technologies in Materials Science【電子書籍】Computational Methods in Catalysis and Materials Science An Introduction for Scientists and Engineers【電子書籍】洋書 Paperback, Computational Materials Science: From Ab Initio to Monte Carlo Methods (Springer Series in Solid-State Sciences)Computational Materials Science Surfaces, Interfaces, Crystallization【電子書籍】 A.M. OvrutskyMultiscale Paradigms in Integrated Computational Materials Science and Engineering Materials Theory, Modeling, and Simulation for Predictive Design【電子書籍】
 

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  • <p>Several statistical techniques are used for the design of materials through extraction of knowledge from existing data banks. These approaches are getting more attention with the application of computational intelligence techniques. This book illustrates the alternative but effective methods of designing materials, where models are developed through capturing the inherent correlations among the variables on the basis of available imprecise knowledge in the form of rules or database, as well as through the extraction of knowledge from experimental or industrial database, and using optimization tools.</p>画面が切り替わりますので、しばらくお待ち下さい。 ※ご購入は、楽天kobo商品ページからお願いします。※切り替わらない場合は、こちら をクリックして下さい。 ※このページからは注文できません。
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  • <p>This book presents advanced and practical techniques for performance optimization for highly parallel processing. Featuring various parallelization techniques in material science, it is a valuable resource for anyone developing software codes for computational sciences such as physics, chemistry, biology, earth sciences, space science, weather, disaster prevention and manufacturing, as well as for anyone using those software codes.</p> <p>Chapter 1 outlines supercomputers and includes a brief explanation of the history of hardware. Chapter 2 presents procedures for performance evaluation, while Chapter 3 describes the set of tuned applications in materials science, nanoscience and nanotechnology, earth science and engineering on the K computer. Introducing the order-N method, based on density functional theory (DFT) calculation, Chapter 4 explains how to extend the applicability of DFT to large-scale systems by reducing the computational complexity. Chapter 5 discusses acce...
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  • <p>This book provides a unique and comprehensive overview of the latest advances, challenges and accomplishments in the rapidly growing field of theoretical and computational materials science. Today, an increasing number of industrial communities rely more and more on advanced atomic-scale methods to obtain reliable predictions of materials properties, complement qualitative experimental analyses and circumvent experimental difficulties. The book examines some of the latest and most advanced simulation techniques currently available, as well as up-to-date theoretical approaches adopted by a selected panel of twelve international research teams. It covers a wide range of novel and advanced materials, exploring their structural, elastic, optical, mass and electronic transport properties. The cutting-edge techniques presented appeal to physicists, applied mathematicians and engineers interested in advanced simulation methods in materials science. The book can also be used as additio...
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  • <p>Volume 45 in the highly successful series Handbook of Porphyrin Science presents three very informative chapters of significant topical interest to researchers in the broad field of porphyrin science. The first chapter (Chapter 215) systematically describes in great detail the many synthetic methods utilized for the preparation of both metal-free and metallo-phthalocyanines. In the second chapter (Chapter 216), new developments in the synthesis, structure, and circular dichroism of chiral porphyrin systems are discussed in depth. The third and final chapter in this volume (Chapter 217) describes up-to-date advances in the use of computational methodology for the design and synthesis of functionally useful tetrapyrroles such as phthalocyanines, porphyrins and 9. The volume concludes with a useful comprehensive index.The overall emphasis of Volume 45 of the Handbook of Porphyrin Science series, centers on synthetic methodology and processes, with a diversion in Chapter 217 to inc...
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  • <p>This book provides a comprehensive overview of the current progress in fiber-reinforced plastics (FRP), covering manufacturing, mechanical behavior, and resistance performance. It includes the elastic and damage behavior of unidirectional FRP, and highlights the improvements achieved by adding multiwall carbon nanotubes. The material resistance is assessed through fatigue response, local behavior, local properties, and failure mechanisms, including crack density and microcrack propagation behavior. The book also explores the degradation of macroscopic mechanical properties such as elastic modulus and compressive strength versus plastic strains. Additionally, it focuses on the progress made in out-of-plane composite characterization and modeling response for simulations of critical mechanical parts currently used in different industries, thanks to advances in manufacturing techniques that allow for the production of increasingly complex and thicker geometries.</p>画面が切り替...
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  • <p>This proceedings book offers a collection of high-quality, peer-reviewed research papers presented at the International Conference of Experimental and Numerical Investigations and New Technologies (CNNTech2019) held in Zlatibor, Serbia, from 2 to 5 July 2019. Discussing various industrial, engineering and scientific applications of the engineering techniques, it provides researchers from academia and industry with a platform to present their original work and exchange ideas, experiences, information, techniques, applications and innovations in the fields of mechanical engineering, materials science, chemical and process engineering, experimental techniques, numerical methods and new technologies.</p>画面が切り替わりますので、しばらくお待ち下さい。 ※ご購入は、楽天kobo商品ページからお願いします。※切り替わらない場合は、こちら をクリックして下さい。 ※このページからは注文できません。
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  • <p>Professionally converted for accurate flowing-text e-book format reproduction, this study provides unique information about the U.S. Army Research Laboratory (ARL), which is the Department of the Army's corporate laboratory, strategically placed within the Army Materiel Command (AMC), an institutional Army Command (ACOM).<br /> ARL is also the Army's sole fundamental research laboratory focused on scientific discovery, technological innovation, and transition of knowledge products; it impacts the Army and broader DoD science and technology (S&T) communities through transition of knowledge products to its sister Research, Development, and Engineering Centers (RDECs) within the Army Research, Development, and Engineering Command (RDECOM) - an AMC Major Subordinate Command (MSC), Army PMs/PEOs, the other services, and industry. ARL executes fundamental research, defined as Basic Research (BA 1) and Applied Research (BA 2), to address enduring S&T challenges that have been identi...
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  • <p>Emphasising essential methods and universal principles, this textbook provides everything students need to understand the basics of simulating materials behaviour. All the key topics are covered from electronic structure methods to microstructural evolution, appendices provide crucial background material, and a wealth of practical resources are available online to complete the teaching package. Modelling is examined at a broad range of scales, from the atomic to the mesoscale, providing students with a solid foundation for future study and research. Detailed, accessible explanations of the fundamental equations underpinning materials modelling are presented, including a full chapter summarising essential mathematical background. Extensive appendices, including essential background on classical and quantum mechanics, electrostatics, statistical thermodynamics and linear elasticity, provide the background necessary to fully engage with the fundamentals of computational modelling....
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  • <p>This textbook introduces modern techniques based on computer simulation to study materials science. It starts from first principles calculations enabling to calculate the physical and chemical properties by solving a many-body Schroedinger equation with Coulomb forces. For the exchange-correlation term, the local density approximation is usually applied. After the introduction of the first principles treatment, tight-binding and classical potential methods are briefly introduced to indicate how one can increase the number of atoms in the system. In the second half of the book, Monte Carlo simulation is discussed in detail. Problems and solutions are provided to facilitate understanding. Readers will gain sufficient knowledge to begin theoretical studies in modern materials research.<br /> This second edition includes a lot of recent theoretical techniques in materials research. With the computers power now available, it is possible to use these numerical techniques to study v...
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  • <p>This book provides a broad and nuanced overview of the achievements and legacy of Professor William (“Bill”) Goddard in the field of computational materials and molecular science. Leading researchers from around the globe discuss Goddard’s work and its lasting impacts, which can be seen in today’s cutting-edge chemistry, materials science, and biology techniques. Each section of the book closes with an outline of the prospects for future developments.</p> <p>In the course of a career spanning more than 50 years, Goddard’s seminal work has led to dramatic advances in a diverse range of science and engineering fields. Presenting scientific essays and reflections by students, postdoctoral associates, collaborators and colleagues, the book describes the contributions of one of the world’s greatest materials and molecular scientists in the context of theory, experimentation, and applications, and examines his legacy in each area, from conceptualization (the first mile)to develop...
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  • <p>This book covers the essentials of Computational Science and gives tools and techniques to solve materials science problems using molecular dynamics (MD) and first-principles methods. The new edition expands upon the density functional theory (DFT) and how the original DFT has advanced to a more accurate level by GGA+U and hybrid-functional methods. It offers 14 new worked examples in the LAMMPS, Quantum Espresso, VASP and MedeA-VASP programs, including computation of stress-strain behavior of Si-CNT composite, mean-squared displacement (MSD) of ZrO2-Y2O3, band structure and phonon spectra of silicon, and Mo-S battery system. It discusses methods once considered too expensive but that are now cost-effective. New examples also include various post-processed results using VESTA, VMD, VTST, and MedeA.</p>画面が切り替わりますので、しばらくお待ち下さい。 ※ご購入は、楽天kobo商品ページからお願いします。※切り替わらない場合は、こちら をクリックして下さい。 ※このページからは注文できま...
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  • <p>New technologies are made possible by new materials, and until recently new materials could only be discovered experimentally. Recent advances in solving the crystal structure prediction problem means that the computational design of materials is now a reality.</p> <p><strong>Computational Materials Discovery</strong> provides a comprehensive review of this field covering different computational methodologies as well as specific applications of materials design. The book starts by illustrating how and why first-principle calculations have gained importance in the process of materials discovery. The book is then split into three sections, the first exploring different approaches and ideas including crystal structure prediction from evolutionary approaches, data mining methods and applications of machine learning. Section two then looks at examples of designing specific functional materials with special technological relevance for example photovoltaic materials, supercond...
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  • <p>This book provides in-depth knowledge to solve engineering, geometrical, mathematical, and scientific problems with the help of advanced computational methods with a focus on mechanical and materials engineering. Divided into three subsections covering design and fluids, thermal engineering and materials engineering, each chapter includes exhaustive literature review along with thorough analysis and future research scope. Major topics covered pertains to computational fluid dynamics, mechanical performance, design, and fabrication including wide range of applications in industries as automotive, aviation, electronics, nuclear and so forth.</p> <ul> <li></li> <li>Covers computational methods in design and fluid dynamics with a focus on computational fluid dynamics</li> <li></li> <li>Explains advanced material applications and manufacturing in labs using novel alloys and introduces properties in material</li> <li></li> <li>Discusses fabrication of graphe...
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  • <p>Combining previously unconnected computational methods, this monograph discusses the latest basic schemes and algorithms for the solution of fluid, heat and mass transfer problems coupled with electrodynamics. It presents the necessary mathematical background of computational thermo-fluid dynamics, the numerical implementation and the application to real-world problems. Particular emphasis is placed throughout on the use of electromagnetic fields to control the heat, mass and fluid flows in melts and on phase change phenomena during the solidification of pure materials and binary alloys. However, the book provides much more than formalisms and algorithms; it also stresses the importance of good, feasible and workable models to understand complex systems, and develops these in detail.<br /> Bringing computational fluid dynamics, thermodynamics and electrodynamics together, this is a useful source for materials scientists, PhD students, solid state physicists, process engineers...
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  • COMPUTATIONAL MECHANICS OF ARB Springer Tracts in Mechanical Engineering Siqiang Wang Shunying Ji SPRINGER NATURE2024 Hardcover 2024 English ISBN:9789819999262 洋書 Computers & Science(コンピューター&科学) Technology
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  • <p>Advanced materials are essential for economic security and human well-being, with applications in industries aimed at addressing challenges in clean energy, national security, and human welfare. Yet, it can take years to move a material to the market after its initial discovery. Computational techniques have accelerated the exploration and development of materials, offering the chance to move new materials to the market quickly. <em>Computational Technologies in Materials Science</em> addresses topics related to AI, machine learning, deep learning, and cloud computing in materials science. It explores characterization and fabrication of materials, machine-learning-based models, and computational intelligence for the synthesis and identification of materials. This book</p> <p>? Covers material testing and development using computational intelligence</p> <p>? Highlights the technologies to integrate computational intelligence and materials science</p> <p>? Details...
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  • <p>This practical guide describes the basic computational methodologies for catalysis and materials science at an introductory level, presenting the methods with relevant applications, such as spectroscopic properties, chemical reactivity and transport properties of catalytically interesting materials. Edited and authored by internationally recognized scientists, the text provides examples that may be considered and followed as state-of-the art.</p>画面が切り替わりますので、しばらくお待ち下さい。 ※ご購入は、楽天kobo商品ページからお願いします。※切り替わらない場合は、こちら をクリックして下さい。 ※このページからは注文できません。
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  • *** We ship internationally, so do not use a package forwarding service. We cannot ship to a package forwarding company address because of the Japanese customs regulation. If it is shipped and customs office does not let the package go, we do not make a refund. 【注意事項】 *** 特に注意してください。 *** ・個人ではない法人・団体名義での購入はできません。この場合税関で滅却されてもお客様負担になりますので御了承願います。 ・お名前にカタカナが入っている場合法人である可能性が高いため当店システムから自動保留します。カタカナで記載が必要な場合はカタカナ変わりローマ字で記載してください。 ・お名前またはご住所が法人・団体名義(XX株式会社等)、商店名などを含めている場合、または電話番号が個人のものではない場合、税関から法人名義でみなされますのでご注意ください。 ・転送サービス会社への発送もできません。この場合税関で滅却されてもお客様負担になりますので御了承願います。 *** ・注文後品切れや価格変動でキャンセルされる場合がございますので予めご了承願います。 ・当店でご購入された商品は、原則として、「個...
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  • <p>Computational Materials Science provides the theoretical basis necessary for understanding atomic surface phenomena and processes of phase transitions, especially crystallization, is given. The most important information concerning computer simulation by different methods and simulation techniques for modeling of physical systems is also presented. A number of results are discussed regarding modern studies of surface processes during crystallization. There is sufficiently full information on experiments, theory, and simulations concerning the surface roughening transition, kinetic roughening, nucleation kinetics, stability of crystal shapes, thin film formation, imperfect structure of small crystals, size dependent growth velocity, distribution coefficient at growth from alloy melts, superstructure ordering in the intermetallic compound.</p> <p>Computational experiments described in the last chapter allow visualization of the course of many processes and better understandin...
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  • <p>This book presents cutting-edge concepts, paradigms, and research highlights in the field of computational materials science and engineering, and provides a fresh, up-to-date perspective on solving present and future materials challenges. The chapters are written by not only pioneers in the fields of computational materials chemistry and materials science, but also experts in multi-scale modeling and simulation as applied to materials engineering. Pedagogical introductions to the different topics and continuity between the chapters are provided to ensure the appeal to a broad audience and to address the applicability of integrated computational materials science and engineering for solving real-world problems.</p>画面が切り替わりますので、しばらくお待ち下さい。 ※ご購入は、楽天kobo商品ページからお願いします。※切り替わらない場合は、こちら をクリックして下さい。 ※このページからは注文できません。
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