Computational Technologies in Materials Science

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Publisher : CRC Press
ISBN 13 : 1000459748
Total Pages : 251 pages
Book Rating : 4.0/5 (4 download)

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Book Synopsis Computational Technologies in Materials Science by : Shubham Tayal

Download or read book Computational Technologies in Materials Science written by Shubham Tayal and published by CRC Press. This book was released on 2021-10-06 with total page 251 pages. Available in PDF, EPUB and Kindle. Book excerpt: • Covers material testing and development using computational intelligence • Highlights the technologies to integrate computational intelligence and materials sciences • Discusses how computational tools can generate new materials with advanced applications • Details case studies and detailed applications • Investigates challenges in developing and using computational intelligence in materials science • Analyzes historic changes that are taking place in designing of materials

Computational Materials Science

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Author :
Publisher : Springer
ISBN 13 : 3662565420
Total Pages : 433 pages
Book Rating : 4.6/5 (625 download)

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Book Synopsis Computational Materials Science by : Kaoru Ohno

Download or read book Computational Materials Science written by Kaoru Ohno and published by Springer. This book was released on 2018-04-14 with total page 433 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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. 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 various physical and chemical properties of complex materials from first principles. The new edition also covers empirical methods, such as tight-binding and molecular dynamics.

Computational Materials Science for Thin-Film Solar Cells

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Publisher : Springer
ISBN 13 : 9783642242847
Total Pages : 300 pages
Book Rating : 4.2/5 (428 download)

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Book Synopsis Computational Materials Science for Thin-Film Solar Cells by : Hans-Werner Schock

Download or read book Computational Materials Science for Thin-Film Solar Cells written by Hans-Werner Schock and published by Springer. This book was released on 2015-12-06 with total page 300 pages. Available in PDF, EPUB and Kindle. Book excerpt: Scientists and engineers in academic and industrial research experience a strong evolving discipline: Computational Materials Science. This discipline provides materials insights that are not readily achievable by experiments, and it offers the opportunity to design materials and composites “ab-initio”. This book presents the methods and the practical use of Computational Materials Science using two distinct examples: the development of optimized or alternative materials for CIGS (Copper-Indium-Gallium-di-Selenide) photovoltaics and the optimization of CIGS thin film solar cells for maximum efficiency. After a general introduction the theoretical background of the book is illustrated: The strategies and principles of High Performance Computing (HPC) for materials science are covered and rounded out by a number of examples for highly parallel computing. Next theory and working principles of solar cells are depicted with emphasis on CIGS. Finally the theory of the quantum mechanical simulations (Density Functional Theory, Monte Carlo simulations for canonical and grand-canonical ensembles, cluster expansions) and the software used for these purposes are presented. In the practical section of the book the simulation work for the various functional layers of the CIGS cell is described in detail: After general electronic structure calculations for the CIGS photo absorber light is shed on the role of the Indium/Gallium distribution as well as on the influence of vacancies in chalcopyrite structures. Base requirements for the buffer layer are defined and simulation results from a search for alternative (Cadmium-free) buffer compounds are presented. Experimental results for synthesized replacement materials complete this part of the work. The optimization of the system transparent conductive oxide (TCO) / contact grid for maximum overall cell efficiency is described. The charge transport through TCO/grid is modelled by a Finite Element Method and cell efficiencies are calculated considering ohmic as well as optical losses. The last section of the book outlines the simulation results implications on the optimization of thin film cell processing. Special emphasis is placed on the influence of process temperatures on film homogeneity and cell efficiency as well as on the requirements for substrate selection. The calculations are validated by experimental results.

Computational Materials Science

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Publisher : IOS Press
ISBN 13 : 9781586033354
Total Pages : 450 pages
Book Rating : 4.0/5 (333 download)

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Book Synopsis Computational Materials Science by : Eugene Kotomin

Download or read book Computational Materials Science written by Eugene Kotomin and published by IOS Press. This book was released on 2003 with total page 450 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Advanced Characterization of Thin Film Solar Cells

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Publisher : Institution of Engineering and Technology
ISBN 13 : 1839530235
Total Pages : 457 pages
Book Rating : 4.8/5 (395 download)

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Book Synopsis Advanced Characterization of Thin Film Solar Cells by : Mowafak Al-Jassim

Download or read book Advanced Characterization of Thin Film Solar Cells written by Mowafak Al-Jassim and published by Institution of Engineering and Technology. This book was released on 2020-09-17 with total page 457 pages. Available in PDF, EPUB and Kindle. Book excerpt: Polycrystalline thin-film solar cells have reached a levelized cost of energy that is competitive with all other sources of electricity. The technology has significantly improved in recent years, with laboratory cell efficiencies for cadmium telluride (CdTe), perovskites, and copper indium gallium diselenide (CIGS) each exceeding 22 percent. Both CdTe and CIGS solar panels are now produced at the gigawatt scale. However, there are ongoing challenges, including the continued need to improve performance and stability while reducing cost. Advancing polycrystalline solar cell technology demands an in-depth understanding of efficiency, scaling, and degradation mechanisms, which requires sophisticated characterization methods. These methods will enable researchers and manufacturers to improve future solar modules and systems.

Copper Zinc Tin Sulfide-Based Thin-Film Solar Cells

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Author :
Publisher : John Wiley & Sons
ISBN 13 : 1118437853
Total Pages : 449 pages
Book Rating : 4.1/5 (184 download)

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Book Synopsis Copper Zinc Tin Sulfide-Based Thin-Film Solar Cells by : Kentaro Ito

Download or read book Copper Zinc Tin Sulfide-Based Thin-Film Solar Cells written by Kentaro Ito and published by John Wiley & Sons. This book was released on 2014-12-11 with total page 449 pages. Available in PDF, EPUB and Kindle. Book excerpt: Beginning with an overview and historical background of Copper Zinc Tin Sulphide (CZTS) technology, subsequent chapters cover properties of CZTS thin films, different preparation methods of CZTS thin films, a comparative study of CZTS and CIGS solar cell, computational approach, and future applications of CZTS thin film solar modules to both ground-mount and rooftop installation. The semiconducting compound (CZTS) is made up earth-abundant, low-cost and non-toxic elements, which make it an ideal candidate to replace Cu(In,Ga)Se2 (CIGS) and CdTe solar cells which face material scarcity and toxicity issues. The device performance of CZTS-based thin film solar cells has been steadily improving over the past 20 years, and they have now reached near commercial efficiency levels (10%). These achievements prove that CZTS-based solar cells have the potential to be used for large-scale deployment of photovoltaics. With contributions from leading researchers from academia and industry, many of these authors have contributed to the improvement of its efficiency, and have rich experience in preparing a variety of semiconducting thin films for solar cells.

Computational Materials System Design

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Publisher : Springer
ISBN 13 : 3319682806
Total Pages : 239 pages
Book Rating : 4.3/5 (196 download)

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Book Synopsis Computational Materials System Design by : Dongwon Shin

Download or read book Computational Materials System Design written by Dongwon Shin and published by Springer. This book was released on 2017-11-10 with total page 239 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book provides state-of-the-art computational approaches for accelerating materials discovery, synthesis, and processing using thermodynamics and kinetics. The authors deliver an overview of current practical computational tools for materials design in the field. They describe ways to integrate thermodynamics and kinetics and how the two can supplement each other.

Advanced Characterization Techniques for Thin Film Solar Cells

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Publisher : John Wiley & Sons
ISBN 13 : 352769904X
Total Pages : 760 pages
Book Rating : 4.5/5 (276 download)

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Book Synopsis Advanced Characterization Techniques for Thin Film Solar Cells by : Daniel Abou-Ras

Download or read book Advanced Characterization Techniques for Thin Film Solar Cells written by Daniel Abou-Ras and published by John Wiley & Sons. This book was released on 2016-07-13 with total page 760 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book focuses on advanced characterization methods for thin-film solar cells that have proven their relevance both for academic and corporate photovoltaic research and development. After an introduction to thin-film photovoltaics, highly experienced experts report on device and materials characterization methods such as electroluminescence analysis, capacitance spectroscopy, and various microscopy methods. In the final part of the book simulation techniques are presented which are used for ab-initio calculations of relevant semiconductors and for device simulations in 1D, 2D and 3D. Building on a proven concept, this new edition also covers thermography, transient optoelectronic methods, and absorption and photocurrent spectroscopy.

Computational Approaches to Energy Materials

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Publisher : John Wiley & Sons
ISBN 13 : 1118551443
Total Pages : 423 pages
Book Rating : 4.1/5 (185 download)

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Book Synopsis Computational Approaches to Energy Materials by : Richard Catlow

Download or read book Computational Approaches to Energy Materials written by Richard Catlow and published by John Wiley & Sons. This book was released on 2013-04-03 with total page 423 pages. Available in PDF, EPUB and Kindle. Book excerpt: The development of materials for clean and efficient energy generation and storage is one of the most rapidly developing, multi-disciplinary areas of contemporary science, driven primarily by concerns over global warming, diminishing fossil-fuel reserves, the need for energy security, and increasing consumer demand for portable electronics. Computational methods are now an integral and indispensable part of the materials characterisation and development process. Computational Approaches to Energy Materials presents a detailed survey of current computational techniques for the development and optimization of energy materials, outlining their strengths, limitations, and future applications. The review of techniques includes current methodologies based on electronic structure, interatomic potential and hybrid methods. The methodological components are integrated into a comprehensive survey of applications, addressing the major themes in energy research. Topics covered include: • Introduction to computational methods and approaches • Modelling materials for energy generation applications: solar energy and nuclear energy • Modelling materials for storage applications: batteries and hydrogen • Modelling materials for energy conversion applications: fuel cells, heterogeneous catalysis and solid-state lighting • Nanostructures for energy applications This full colour text is an accessible introduction for newcomers to the field, and a valuable reference source for experienced researchers working on computational techniques and their application to energy materials.

Solar Cells

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Publisher : Springer Nature
ISBN 13 : 3030363546
Total Pages : 354 pages
Book Rating : 4.0/5 (33 download)

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Book Synopsis Solar Cells by : S. K. Sharma

Download or read book Solar Cells written by S. K. Sharma and published by Springer Nature. This book was released on 2020-01-07 with total page 354 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book addresses the rapidly developing class of solar cell materials and designed to provide much needed information on the fundamental principles of these materials, together with how these are employed in photovoltaic applications. A special emphasize have been given for the space applications through study of radiation tolerant solar cells. This book present a comprehensive research outlining progress on the synthesis, fabrication and application of solar cells from fundamental to device technology and is helpful for graduate students, researchers, and technologists engaged in research and development of materials.

Chemistry, Structure, and Bonding of Zintl Phases and Ions

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Author :
Publisher : VCH Publishers
ISBN 13 :
Total Pages : 344 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis Chemistry, Structure, and Bonding of Zintl Phases and Ions by : Susan Mary Kauzlarich

Download or read book Chemistry, Structure, and Bonding of Zintl Phases and Ions written by Susan Mary Kauzlarich and published by VCH Publishers. This book was released on 1996 with total page 344 pages. Available in PDF, EPUB and Kindle. Book excerpt: Seven chapters report current research into the phases and ions of a class of compounds that are electronically positioned between the intermetallic compounds and insulating valence compounds. They cover structure and bonding at the Zintl border, structural patterns of homo- and hetero-nuclear anions and related intermetallic compounds and concepts for interpreting them, the early p-block elements, polyanions in liquid ionic alloys, molecular transition metal complexes, transition metal compounds, and synthesizing and characterizing intermetallic materials using Zintl phases as precursors. An introduction surveys the life and work of German chemist Eduard Zintl (1898-1941). Annotation copyright by Book News, Inc., Portland, OR

Machine Learning for Advanced Functional Materials

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Publisher : Springer Nature
ISBN 13 : 9819903939
Total Pages : 306 pages
Book Rating : 4.8/5 (199 download)

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Book Synopsis Machine Learning for Advanced Functional Materials by : Nirav Joshi

Download or read book Machine Learning for Advanced Functional Materials written by Nirav Joshi and published by Springer Nature. This book was released on 2023-05-22 with total page 306 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents recent advancements of machine learning methods and their applications in material science and nanotechnologies. It provides an introduction to the field and for those who wish to explore machine learning in modeling as well as conduct data analyses of material characteristics. The book discusses ways to enhance the material’s electrical and mechanical properties based on available regression methods for supervised learning and optimization of material attributes. In summary, the growing interest among academics and professionals in the field of machine learning methods in functional nanomaterials such as sensors, solar cells, and photocatalysis is the driving force for behind this book. This is a comprehensive scientific reference book on machine learning for advanced functional materials and provides an in-depth examination of recent achievements in material science by focusing on topical issues using machine learning methods.

Solar Energy Conversion II

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Publisher : Elsevier
ISBN 13 : 1483155900
Total Pages : 660 pages
Book Rating : 4.4/5 (831 download)

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Book Synopsis Solar Energy Conversion II by : A. F. Janzen

Download or read book Solar Energy Conversion II written by A. F. Janzen and published by Elsevier. This book was released on 2013-10-22 with total page 660 pages. Available in PDF, EPUB and Kindle. Book excerpt: Solar Energy Conversion II presents the proceedings of the 1980 International Symposium on Solar Energy Utilization, held in Ontario, Canada on August 10-24, 1980. This book provides information on the utilization of solar energy and on the difficulties encountered in its implementation. Organized into 42 chapters, this compilation of papers begins with an overview of the important parameter in solar radiation measurement. This text then examines the use of solar radiation measurement, the solar radiation scales, the solar radiation units, and the types of solar radiation. Other chapters consider the general problems linked with building up data banks of observed solar radiation data. This book discusses as well the fundamental modes of heat transfer. The final chapter deals with the necessity to incorporate energy education into other disciplines like space geometry. This book is a valuable resource for politicians, government officials, engineers, scientists, and research workers. Technologists working on solar energy will also find this book useful.

Crystallography in Materials Science

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Publisher : Walter de Gruyter GmbH & Co KG
ISBN 13 : 3110674912
Total Pages : 369 pages
Book Rating : 4.1/5 (16 download)

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Book Synopsis Crystallography in Materials Science by : Susan Schorr

Download or read book Crystallography in Materials Science written by Susan Schorr and published by Walter de Gruyter GmbH & Co KG. This book was released on 2021-07-05 with total page 369 pages. Available in PDF, EPUB and Kindle. Book excerpt: The knowledge about crystal structure and its correlation with physical properties is the prerequisite for designing new materials with taylored properties. This work provides for researchers and graduates a valuable resource on various techniques for crystal structure determinations. By discussing a broad range of different materials and tools the authors enable the understanding of why a material might be suitable for a particular application.

Unconventional Thin Film Photovoltaics

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Publisher : Royal Society of Chemistry
ISBN 13 : 1782624066
Total Pages : 502 pages
Book Rating : 4.7/5 (826 download)

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Book Synopsis Unconventional Thin Film Photovoltaics by : Enrico Da Como

Download or read book Unconventional Thin Film Photovoltaics written by Enrico Da Como and published by Royal Society of Chemistry. This book was released on 2016-08-04 with total page 502 pages. Available in PDF, EPUB and Kindle. Book excerpt: Covering both organic materials, where recent advances in the understanding of device physics is driving progress, and the newly emerging field of mixed halide perovskites, which are challenging the efficiencies of conventional thin film PV cells, this book provides a balanced overview of the experimental and theoretical aspects of these two classes of solar cell. The book explores both the experimental and theoretical aspects of these solar cell classes. Emphasis is placed on understanding the fundamental physics of the devices. The book also discusses modelling over many length scales, from nano to macro. The first book to cover perovskites, this is an important reference for industrialists and researchers working in energy technologies and materials.

Evolution of Thin Film Morphology

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Publisher : Springer Science & Business Media
ISBN 13 : 0387751092
Total Pages : 206 pages
Book Rating : 4.3/5 (877 download)

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Book Synopsis Evolution of Thin Film Morphology by : Matthew Pelliccione

Download or read book Evolution of Thin Film Morphology written by Matthew Pelliccione and published by Springer Science & Business Media. This book was released on 2008-01-29 with total page 206 pages. Available in PDF, EPUB and Kindle. Book excerpt: The focus of this book is on modeling and simulations used in research on the morphological evolution during film growth. The authors emphasize the detailed mathematical formulation of the problem. The book will enable readers themselves to set up a computational program to investigate specific topics of interest in thin film deposition. It will benefit those working in any discipline that requires an understanding of thin film growth processes.

Energy Conversion and Green Energy Storage

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Publisher : CRC Press
ISBN 13 : 1000625281
Total Pages : 231 pages
Book Rating : 4.0/5 (6 download)

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Book Synopsis Energy Conversion and Green Energy Storage by : Amit Soni

Download or read book Energy Conversion and Green Energy Storage written by Amit Soni and published by CRC Press. This book was released on 2022-09-14 with total page 231 pages. Available in PDF, EPUB and Kindle. Book excerpt: Energy Conversion and Green Energy Storage presents recent developments in renewable energy conversion and green energy storage. Covering technical expansions in renewable energy and applications, energy storage, and solar photovoltaics, the book features chapters written by global experts in the field. Providing insights related to various forms of renewable energy, the book discusses developments in solar photovoltaic applications. The book also includes simulation codes and programs, such as Wien2k code, VASP code, and MATLAB®. The book serves as a useful reference for researchers, graduate students, and engineers in the field of energy.