Machine Learning in 2D Materials Science

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Author :
Publisher : CRC Press
ISBN 13 : 1000987434
Total Pages : 249 pages
Book Rating : 4.0/5 (9 download)

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Book Synopsis Machine Learning in 2D Materials Science by : Parvathi Chundi

Download or read book Machine Learning in 2D Materials Science written by Parvathi Chundi and published by CRC Press. This book was released on 2023-11-13 with total page 249 pages. Available in PDF, EPUB and Kindle. Book excerpt: Data science and machine learning (ML) methods are increasingly being used to transform the way research is being conducted in materials science to enable new discoveries and design new materials. For any materials science researcher or student, it may be daunting to figure out if ML techniques are useful for them or, if so, which ones are applicable in their individual contexts, and how to study the effectiveness of these methods systematically. KEY FEATURES • Provides broad coverage of data science and ML fundamentals to materials science researchers so that they can confidently leverage these techniques in their research projects. • Offers introductory material in topics such as ML, data integration, and 2D materials. • Provides in-depth coverage of current ML methods for validating 2D materials using both experimental and simulation data, researching and discovering new 2D materials, and enhancing ML methods with physical properties of materials. • Discusses customized ML methods for 2D materials data and applications and high-throughput data acquisition. • Describes several case studies illustrating how ML approaches are currently leading innovations in the discovery, development, manufacturing, and deployment of 2D materials needed for strengthening industrial products. • Gives future trends in ML for 2D materials, explainable AI, and dealing with extremely large and small, diverse datasets. Aimed at materials science researchers, this book allows readers to quickly, yet thoroughly, learn the ML and AI concepts needed to ascertain the applicability of ML methods in their research.

Machine Learning in Materials Science

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Author :
Publisher : American Chemical Society
ISBN 13 : 0841299463
Total Pages : 176 pages
Book Rating : 4.8/5 (412 download)

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Book Synopsis Machine Learning in Materials Science by : Keith T. Butler

Download or read book Machine Learning in Materials Science written by Keith T. Butler and published by American Chemical Society. This book was released on 2022-06-16 with total page 176 pages. Available in PDF, EPUB and Kindle. Book excerpt: Machine Learning for Materials Science provides the fundamentals and useful insight into where Machine Learning (ML) will have the greatest impact for the materials science researcher. This digital primer provides example methods for ML applied to experiments and simulations, including the early stages of building an ML solution for a materials science problem, concentrating on where and how to get data and some of the considerations when choosing an approach. The authors demonstrate how to build more robust models, how to make sure that your colleagues trust the results, and how to use ML to accelerate or augment simulations, by introducing methods in which ML can be applied to analyze and process experimental data. They also cover how to build integrated closed-loop experiments where ML is used to plan the course of a materials optimization experiment and how ML can be utilized in the discovery of materials on computers.

Artificial Intelligence for Materials Science

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Author :
Publisher : Springer Nature
ISBN 13 : 3030683109
Total Pages : 231 pages
Book Rating : 4.0/5 (36 download)

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Book Synopsis Artificial Intelligence for Materials Science by : Yuan Cheng

Download or read book Artificial Intelligence for Materials Science written by Yuan Cheng and published by Springer Nature. This book was released on 2021-03-26 with total page 231 pages. Available in PDF, EPUB and Kindle. Book excerpt: Machine learning methods have lowered the cost of exploring new structures of unknown compounds, and can be used to predict reasonable expectations and subsequently validated by experimental results. As new insights and several elaborative tools have been developed for materials science and engineering in recent years, it is an appropriate time to present a book covering recent progress in this field. Searchable and interactive databases can promote research on emerging materials. Recently, databases containing a large number of high-quality materials properties for new advanced materials discovery have been developed. These approaches are set to make a significant impact on human life and, with numerous commercial developments emerging, will become a major academic topic in the coming years. This authoritative and comprehensive book will be of interest to both existing researchers in this field as well as others in the materials science community who wish to take advantage of these powerful techniques. The book offers a global spread of authors, from USA, Canada, UK, Japan, France, Russia, China and Singapore, who are all world recognized experts in their separate areas. With content relevant to both academic and commercial points of view, and offering an accessible overview of recent progress and potential future directions, the book will interest graduate students, postgraduate researchers, and consultants and industrial engineers.

Reviews in Computational Chemistry

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Publisher : John Wiley & Sons
ISBN 13 : 1119157560
Total Pages : 480 pages
Book Rating : 4.1/5 (191 download)

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Book Synopsis Reviews in Computational Chemistry by : Abby L. Parrill

Download or read book Reviews in Computational Chemistry written by Abby L. Parrill and published by John Wiley & Sons. This book was released on 2016-03-09 with total page 480 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered on molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR). This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics in Volume 29 include: Noncovalent Interactions in Density-Functional Theory Long-Range Inter-Particle Interactions: Insights from Molecular Quantum Electrodynamics (QED) Theory Efficient Transition-State Modeling using Molecular Mechanics Force Fields for the Everyday Chemist Machine Learning in Materials Science: Recent Progress and Emerging Applications Discovering New Materials via a priori Crystal Structure Prediction Introduction to Maximally Localized Wannier Functions Methods for a Rapid and Automated Description of Proteins: Protein Structure, Protein Similarity, and Protein Folding

Machine Learning in Chemistry

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Author :
Publisher : Royal Society of Chemistry
ISBN 13 : 1839160241
Total Pages : 564 pages
Book Rating : 4.8/5 (391 download)

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Book Synopsis Machine Learning in Chemistry by : Hugh M Cartwright

Download or read book Machine Learning in Chemistry written by Hugh M Cartwright and published by Royal Society of Chemistry. This book was released on 2020-07-15 with total page 564 pages. Available in PDF, EPUB and Kindle. Book excerpt: Progress in the application of machine learning (ML) to the physical and life sciences has been rapid. A decade ago, the method was mainly of interest to those in computer science departments, but more recently ML tools have been developed that show significant potential across wide areas of science. There is a growing consensus that ML software, and related areas of artificial intelligence, may, in due course, become as fundamental to scientific research as computers themselves. Yet a perception remains that ML is obscure or esoteric, that only computer scientists can really understand it, and that few meaningful applications in scientific research exist. This book challenges that view. With contributions from leading research groups, it presents in-depth examples to illustrate how ML can be applied to real chemical problems. Through these examples, the reader can both gain a feel for what ML can and cannot (so far) achieve, and also identify characteristics that might make a problem in physical science amenable to a ML approach. This text is a valuable resource for scientists who are intrigued by the power of machine learning and want to learn more about how it can be applied in their own field.

Synthesis, Modelling and Characterization of 2D Materials and their Heterostructures

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Author :
Publisher : Elsevier
ISBN 13 : 0128184760
Total Pages : 502 pages
Book Rating : 4.1/5 (281 download)

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Book Synopsis Synthesis, Modelling and Characterization of 2D Materials and their Heterostructures by : Eui-Hyeok Yang

Download or read book Synthesis, Modelling and Characterization of 2D Materials and their Heterostructures written by Eui-Hyeok Yang and published by Elsevier. This book was released on 2020-06-19 with total page 502 pages. Available in PDF, EPUB and Kindle. Book excerpt: Synthesis, Modelling and Characterization of 2D Materials and Their Heterostructures provides a detailed discussion on the multiscale computational approach surrounding atomic, molecular and atomic-informed continuum models. In addition to a detailed theoretical description, this book provides example problems, sample code/script, and a discussion on how theoretical analysis provides insight into optimal experimental design. Furthermore, the book addresses the growth mechanism of these 2D materials, the formation of defects, and different lattice mismatch and interlayer interactions. Sections cover direct band gap, Raman scattering, extraordinary strong light matter interaction, layer dependent photoluminescence, and other physical properties. Explains multiscale computational techniques, from atomic to continuum scale, covering different time and length scales Provides fundamental theoretical insights, example problems, sample code and exercise problems Outlines major characterization and synthesis methods for different types of 2D materials

Deep Learning for the Life Sciences

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Author :
Publisher : O'Reilly Media
ISBN 13 : 1492039802
Total Pages : 236 pages
Book Rating : 4.4/5 (92 download)

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Book Synopsis Deep Learning for the Life Sciences by : Bharath Ramsundar

Download or read book Deep Learning for the Life Sciences written by Bharath Ramsundar and published by O'Reilly Media. This book was released on 2019-04-10 with total page 236 pages. Available in PDF, EPUB and Kindle. Book excerpt: Deep learning has already achieved remarkable results in many fields. Now it’s making waves throughout the sciences broadly and the life sciences in particular. This practical book teaches developers and scientists how to use deep learning for genomics, chemistry, biophysics, microscopy, medical analysis, and other fields. Ideal for practicing developers and scientists ready to apply their skills to scientific applications such as biology, genetics, and drug discovery, this book introduces several deep network primitives. You’ll follow a case study on the problem of designing new therapeutics that ties together physics, chemistry, biology, and medicine—an example that represents one of science’s greatest challenges. Learn the basics of performing machine learning on molecular data Understand why deep learning is a powerful tool for genetics and genomics Apply deep learning to understand biophysical systems Get a brief introduction to machine learning with DeepChem Use deep learning to analyze microscopic images Analyze medical scans using deep learning techniques Learn about variational autoencoders and generative adversarial networks Interpret what your model is doing and how it’s working

Artificial Intelligence-Aided Materials Design

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Publisher : CRC Press
ISBN 13 : 1000541339
Total Pages : 363 pages
Book Rating : 4.0/5 (5 download)

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Book Synopsis Artificial Intelligence-Aided Materials Design by : Rajesh Jha

Download or read book Artificial Intelligence-Aided Materials Design written by Rajesh Jha and published by CRC Press. This book was released on 2022-03-15 with total page 363 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book describes the application of artificial intelligence (AI)/machine learning (ML) concepts to develop predictive models that can be used to design alloy materials, including hard and soft magnetic alloys, nickel-base superalloys, titanium-base alloys, and aluminum-base alloys. Readers new to AI/ML algorithms can use this book as a starting point and use the MATLAB® and Python implementation of AI/ML algorithms through included case studies. Experienced AI/ML researchers who want to try new algorithms can use this book and study the case studies for reference. Offers advantages and limitations of several AI concepts and their proper implementation in various data types generated through experiments and computer simulations and from industries in different file formats Helps readers to develop predictive models through AI/ML algorithms by writing their own computer code or using resources where they do not have to write code Covers downloadable resources such as MATLAB GUI/APP and Python implementation that can be used on common mobile devices Discusses the CALPHAD approach and ways to use data generated from it Features a chapter on metallurgical/materials concepts to help readers understand the case studies and thus proper implementation of AI/ML algorithms under the framework of data-driven materials science Uses case studies to examine the importance of using unsupervised machine learning algorithms in determining patterns in datasets This book is written for materials scientists and metallurgists interested in the application of AI, ML, and data science in the development of new materials.

Machine Learning Applied to Composite Materials

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Publisher : Springer Nature
ISBN 13 : 9811962782
Total Pages : 202 pages
Book Rating : 4.8/5 (119 download)

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Book Synopsis Machine Learning Applied to Composite Materials by : Vinod Kushvaha

Download or read book Machine Learning Applied to Composite Materials written by Vinod Kushvaha and published by Springer Nature. This book was released on 2022-11-29 with total page 202 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book introduces the approach of Machine Learning (ML) based predictive models in the design of composite materials to achieve the required properties for certain applications. ML can learn from existing experimental data obtained from very limited number of experiments and subsequently can be trained to find solutions of the complex non-linear, multi-dimensional functional relationships without any prior assumptions about their nature. In this case the ML models can learn from existing experimental data obtained from (1) composite design based on various properties of the matrix material and fillers/reinforcements (2) material processing during fabrication (3) property relationships. Modelling of these relationships using ML methods significantly reduce the experimental work involved in designing new composites, and therefore offer a new avenue for material design and properties. The book caters to students, academics and researchers who are interested in the field of material composite modelling and design.

2D Materials

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Publisher : Cambridge University Press
ISBN 13 : 1316738132
Total Pages : 521 pages
Book Rating : 4.3/5 (167 download)

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Book Synopsis 2D Materials by : Phaedon Avouris

Download or read book 2D Materials written by Phaedon Avouris and published by Cambridge University Press. This book was released on 2017-06-29 with total page 521 pages. Available in PDF, EPUB and Kindle. Book excerpt: Learn about the most recent advances in 2D materials with this comprehensive and accessible text. Providing all the necessary materials science and physics background, leading experts discuss the fundamental properties of a wide range of 2D materials, and their potential applications in electronic, optoelectronic and photonic devices. Several important classes of materials are covered, from more established ones such as graphene, hexagonal boron nitride, and transition metal dichalcogenides, to new and emerging materials such as black phosphorus, silicene, and germanene. Readers will gain an in-depth understanding of the electronic structure and optical, thermal, mechanical, vibrational, spin and plasmonic properties of each material, as well as the different techniques that can be used for their synthesis. Presenting a unified perspective on 2D materials, this is an excellent resource for graduate students, researchers and practitioners working in nanotechnology, nanoelectronics, nanophotonics, condensed matter physics, and chemistry.

Application of Artificial Intelligence in New Materials Discovery

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Publisher : Materials Research Forum LLC
ISBN 13 : 1644902532
Total Pages : 147 pages
Book Rating : 4.6/5 (449 download)

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Book Synopsis Application of Artificial Intelligence in New Materials Discovery by : Inamuddin

Download or read book Application of Artificial Intelligence in New Materials Discovery written by Inamuddin and published by Materials Research Forum LLC. This book was released on 2023-07-05 with total page 147 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book is concerned with the use of Artificial Intelligence in the discovery, production and application of new engineering materials. Topics covered include nano-robots. data mining, solar energy systems, materials genomics, polymer manufacturing, and energy conversion issues. Keywords: Artificial Intelligence, Mathematical Models, Machine Learning, Artificial Neural Networks, Bayesian Analysis, Vector Machines, Heuristics, Crystal Structure, Component Prediction, Process Optimization, Density Functional Theory, Monitoring, Classification, Nano-Robots, Data Mining, Solar Photovoltaics, Renewable Energy Systems, Alternative Energy Sources, Material Genomics, Polymer Manufacturing, Energy Conversion.

Machine Learning for Materials Discovery

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Author :
Publisher : Springer Nature
ISBN 13 : 3031446224
Total Pages : 287 pages
Book Rating : 4.0/5 (314 download)

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Book Synopsis Machine Learning for Materials Discovery by : N. M. Anoop Krishnan

Download or read book Machine Learning for Materials Discovery written by N. M. Anoop Krishnan and published by Springer Nature. This book was released on with total page 287 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Machine Learning and Data Mining in Materials Science

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Publisher : Frontiers Media SA
ISBN 13 : 2889636518
Total Pages : 235 pages
Book Rating : 4.8/5 (896 download)

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Book Synopsis Machine Learning and Data Mining in Materials Science by : Norbert Huber

Download or read book Machine Learning and Data Mining in Materials Science written by Norbert Huber and published by Frontiers Media SA. This book was released on 2020-04-22 with total page 235 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Machine Learning for Advanced Functional Materials

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Author :
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.

2D Materials

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Publisher : Walter de Gruyter GmbH & Co KG
ISBN 13 : 3110656337
Total Pages : 158 pages
Book Rating : 4.1/5 (16 download)

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Book Synopsis 2D Materials by : Paolo Bondavalli

Download or read book 2D Materials written by Paolo Bondavalli and published by Walter de Gruyter GmbH & Co KG. This book was released on 2022-07-18 with total page 158 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book explains, in an easy way, the diffi cult to grasp concepts behind 2D exotic material properties for physicists, materials scientists, and engineers. This is a new class of phenomena highlighted in 2D materials with strong implications on physics. Physics, also for complex phenomena, is explained in easy terms that are ideal for newcomers to the fi eld and advanced students alike. Theory and specifi c examples of materials and their intriguing properties are discussed focusing on the structure property relationships that govern materials science. Applications for each phenomenon are evoked and a roadmapping is performed.

Manufacturing Engineering and Materials Science

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Author :
Publisher : CRC Press
ISBN 13 : 1000983501
Total Pages : 424 pages
Book Rating : 4.0/5 (9 download)

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Book Synopsis Manufacturing Engineering and Materials Science by : Abhineet Saini

Download or read book Manufacturing Engineering and Materials Science written by Abhineet Saini and published by CRC Press. This book was released on 2023-11-15 with total page 424 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book, which is part of a two-volume handbook set, gives a comprehensive description of recent developments in materials science and manufacturing technology, aiming primarily at its applications in biomedical science, advanced engineering materials, conventional/non-conventional manufacturing techniques, sustainable engineering design, and related domains. Manufacturing Engineering and Materials Science: Tools and Applications provides state-of-the-art research conducted in the fields of technological advancements in surface engineering, tribology, additive manufacturing, precision manufacturing, electromechanical systems, and computer-assisted design and manufacturing. The book captures emerging areas of materials science and advanced manufacturing engineering and presents the most recent trends in research for emerging researchers, field engineers, and academic professionals.

Hands-On Mathematics for Deep Learning

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Publisher : Packt Publishing Ltd
ISBN 13 : 183864184X
Total Pages : 347 pages
Book Rating : 4.8/5 (386 download)

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Book Synopsis Hands-On Mathematics for Deep Learning by : Jay Dawani

Download or read book Hands-On Mathematics for Deep Learning written by Jay Dawani and published by Packt Publishing Ltd. This book was released on 2020-06-12 with total page 347 pages. Available in PDF, EPUB and Kindle. Book excerpt: A comprehensive guide to getting well-versed with the mathematical techniques for building modern deep learning architectures Key FeaturesUnderstand linear algebra, calculus, gradient algorithms, and other concepts essential for training deep neural networksLearn the mathematical concepts needed to understand how deep learning models functionUse deep learning for solving problems related to vision, image, text, and sequence applicationsBook Description Most programmers and data scientists struggle with mathematics, having either overlooked or forgotten core mathematical concepts. This book uses Python libraries to help you understand the math required to build deep learning (DL) models. You'll begin by learning about core mathematical and modern computational techniques used to design and implement DL algorithms. This book will cover essential topics, such as linear algebra, eigenvalues and eigenvectors, the singular value decomposition concept, and gradient algorithms, to help you understand how to train deep neural networks. Later chapters focus on important neural networks, such as the linear neural network and multilayer perceptrons, with a primary focus on helping you learn how each model works. As you advance, you will delve into the math used for regularization, multi-layered DL, forward propagation, optimization, and backpropagation techniques to understand what it takes to build full-fledged DL models. Finally, you’ll explore CNN, recurrent neural network (RNN), and GAN models and their application. By the end of this book, you'll have built a strong foundation in neural networks and DL mathematical concepts, which will help you to confidently research and build custom models in DL. What you will learnUnderstand the key mathematical concepts for building neural network modelsDiscover core multivariable calculus conceptsImprove the performance of deep learning models using optimization techniquesCover optimization algorithms, from basic stochastic gradient descent (SGD) to the advanced Adam optimizerUnderstand computational graphs and their importance in DLExplore the backpropagation algorithm to reduce output errorCover DL algorithms such as convolutional neural networks (CNNs), sequence models, and generative adversarial networks (GANs)Who this book is for This book is for data scientists, machine learning developers, aspiring deep learning developers, or anyone who wants to understand the foundation of deep learning by learning the math behind it. Working knowledge of the Python programming language and machine learning basics is required.