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 #  AuthorTitleAccn#YearItem Type Claims
1 Ben-Naim, Arieh Information Theory I13254 2024 eBook  
2 Hanaor, Dorian A. H Computational Design of Battery Materials I13089 2024 eBook  
3 Mustapha, Aida Proceedings of the 8th International Conference on the Applications of Science and Mathematics I12753 2023 eBook  
4 Jang, Seogjoo J Quantum Mechanics for Chemistry I12746 2023 eBook  
5 KUPROV, ILYA Spin I12677 2023 eBook  
6 Ben-Naim, Arieh Information Theory and Selected Applications I12579 2023 eBook  
7 Mustapha, Aida Binti Proceedings of the 7th International Conference on the Applications of Science and Mathematics 2021 I12419 2022 Book  
8 Murray, Keith Single Molecule Toroics I12337 2022 Book  
9 Kenkre, V. M. (Nitant) Memory Functions, Projection Operators, and the Defect Technique I11741 2021 eBook  
10 Atmanspacher, Harald From Chemistry to Consciousness I10367 2016 eBook  
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TitleInformation Theory : An Exploration Across Disciplines
Author(s)Ben-Naim, Arieh;Dufour, Claude
PublicationCham, 1. Imprint: Springer 2. Springer Nature Switzerland, 2024.
DescriptionXV, 248 p. 103 illus., 42 illus. in color : online resource
Abstract NoteThis monograph explores the interdisciplinary applications of information theory, focusing on the concepts of entropy, mutual information, and their implications in various fields. It explains the fundamental differences between entropy and Shannon???s Measure of Information (SMI), presents the application of information theory to living systems and psychology, and also discusses the role of entropy in art. It critically overviews the definition of correlations and multivariate mutual information.These notions are used to build a new perspective for understanding the irreversibility of processes in macroscopic systems, while the dynamical laws governing the microscopic components are reversible. It also delves into the use of mutual information in linguistics, cryptography, steganography, and communication systems. The book details the theoretical and practical aspects of information theory across a spectrum of disciplines and is a useful tool for any scientist interested in what is usually called entropy
ISBN,Price9783031677472
Keyword(s)1. Chemistry, Physical and theoretical 2. Data structures (Computer science) 3. Data Structures and Information Theory 4. EBOOK 5. EBOOK - SPRINGER 6. INFORMATION THEORY 7. PROBABILITIES 8. PROBABILITY THEORY 9. THEORETICAL CHEMISTRY 10. THERMODYNAMICS
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2.     
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TitleComputational Design of Battery Materials
Author(s)Hanaor, Dorian A. H
PublicationCham, 1. Imprint: Springer 2. Springer International Publishing, 2024.
DescriptionXXIV, 573 p. 241 illus., 233 illus. in color : online resource
Abstract NoteThis book presents an essential survey of the state of the art in the application of diverse computational methods to the interpretation, prediction, and design of high-performance battery materials. Rechargeable batteries have become one of the most important technologies supporting the global transition from fossil fuels to renewable energy sources. Aided by the growth of high-performance computing and machine learning technologies, computational methods are being applied to design the battery materials of the future and pave the way to a more sustainable energy economy. In this contributed collection, leading battery material researchers from across the globe share their methods, insights, and expert knowledge in the application of computational methods for battery material design and interpretation. With chapters featuring an array of computational techniques applied to model the relevant properties of cathodes, anodes, and electrolytes, this book provides the ideal starting point for any researcher looking to integrate computational tools in the development of next-generation battery materials and processes
ISBN,Price9783031473036
Keyword(s)1. BATTERIES 2. Catalysis 3. Chemistry, Physical and theoretical 4. Computational Materials Science 5. CONDENSED MATTER 6. EBOOK 7. EBOOK - SPRINGER 8. Electric batteries 9. FORCE AND ENERGY 10. MACHINE LEARNING 11. MATERIALS 12. Materials for Energy and Catalysis 13. MATERIALS SCIENCE 14. THEORETICAL CHEMISTRY 15. Two-dimensional Materials
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TitleProceedings of the 8th International Conference on the Applications of Science and Mathematics : SCIEMATHIC 2022; 17???19 Oct; Malaysia
Author(s)Mustapha, Aida;Ibrahim, Norzuria;Basri, Hatijah;Rusiman, Mohd Saifullah;Zuhaib Haider Rizvi, Syed
PublicationSingapore, 1. Imprint: Springer 2. Springer Nature Singapore, 2023.
DescriptionXXIII, 431 p. 134 illus., 109 illus. in color : online resource
Abstract NoteThis book presents peer-reviewed articles and recent advances on the potential applications of Science and Mathematics for future technologies, from the 8th International Conference on the Applications of Science and Mathematics (SCIEMATHIC 2022), held in Malaysia. It provides an insight about the leading trends in sustainable Science and Technology. Topics included in this proceedings are in the areas of Mathematics and Statistics, including Natural Science, Engineering and Artificial Intelligence
ISBN,Price9789819928507
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK - SPRINGER 3. Mathematical Modeling and Industrial Mathematics 4. MATHEMATICAL MODELS 5. MATHEMATICAL PHYSICS 6. Statistical Theory and Methods 7. Statistics?? 8. Sustainability 9. THEORETICAL CHEMISTRY
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4.     
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TitleQuantum Mechanics for Chemistry
Author(s)Jang, Seogjoo J
PublicationCham, 1. Imprint: Springer 2. Springer International Publishing, 2023.
DescriptionXVIII, 432 p. 27 illus., 21 illus. in color : online resource
Abstract NoteThis textbook forms the basis for an advanced undergraduate or graduate level quantum chemistry course, and can also serve as a reference for researchers in physical chemistry and chemical physics. In addition to the standard core topics such as principles of quantum mechanics, vibrational and rotational states, hydrogen-like molecules, perturbation theory, variational principles, and molecular orbital theories, this book also covers essential theories of electronic structure calculation, the primary methods for calculating quantum dynamics, and major spectroscopic techniques for quantum measurement. Plus, topics that are overlooked in conventional textbooks such as path integral formulation, open system quantum dynamics methods, and Green???s function approaches are addressed. This book helps readers grasp the essential quantum mechanical principles and results that serve as the foundation of modern chemistry and become knowledgeable in major methods of computational chemistry and spectroscopic experiments being conducted by present-day researchers. Dirac notation is used throughout, and right balance between comprehensiveness, rigor, and readability is achieved, ensuring that the book remains accessible while providing all the relevant details. Complete with exercises, this book is ideal for a course on quantum chemistry or as a self-study resource
ISBN,Price9783031302183
Keyword(s)1. ASTRONOMY 2. Atomic and Molecular Structure and Properties 3. Atomic structure???? 4. Chemistry, Physical and theoretical 5. Chemometrics 6. EBOOK - SPRINGER 7. Fundamental concepts and interpretations of QM 8. Mathematical Applications in Chemistry 9. Molecular structure?? 10. PHYSICAL CHEMISTRY 11. PHYSICS 12. PHYSICS AND ASTRONOMY 13. QUANTUM PHYSICS 14. THEORETICAL CHEMISTRY
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5.     
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TitleSpin : From Basic Symmetries to Quantum Optimal Control
Author(s)KUPROV, ILYA
PublicationCham, 1. Imprint: Springer 2. Springer International Publishing, 2023.
DescriptionXIII, 395 p. 69 illus., 27 illus. in color : online resource
Abstract NoteThis monograph is a fundamental reference for scientists and engineers who encounter spin processes in their work. The author, Ilya Kuprov, derives the concept of spin from basic symmetries and gives an overview of theoretical and computational aspects of spin dynamics: from Dirac equation and spin Hamiltonian, through coherent evolution and relaxation theories, to quantum optimal control, and all the way to practical implementation advice for parallel computers
ISBN,Price9783031056079
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK - SPRINGER 3. MAGNETISM 4. MATHEMATICAL PHYSICS 5. PHYSICAL CHEMISTRY 6. SPECTROSCOPY 7. SPECTRUM ANALYSIS 8. THEORETICAL CHEMISTRY 9. Theoretical, Mathematical and Computational Physics
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6.     
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TitleInformation Theory and Selected Applications
Author(s)Ben-Naim, Arieh
PublicationCham, 1. Imprint: Springer 2. Springer International Publishing, 2023.
DescriptionXV, 232 p. 199 illus., 24 illus. in color : online resource
Abstract NoteThis book focuses on analysing the applications of the Shannon Measure of Information (SMI). The book introduces the concept of frustration and discusses the question of the quantification of this concept within information theory (IT), while it also focuses on the interpretation of the entropy of systems of interacting particles in terms of the SMI and of mutual information. The author examines the question of the possibility of measuring the extent of frustration using mutual information and discusses some classical examples of processes of mixing and assimilation for which the entropy changes are interpreted in terms of SMI. A description of a few binding systems and the interpretation of cooperativity phenomena in terms of mutual information are also presented, along with a detailed discussion on the general method of using maximum SMI in order to find the ???best-guess??? probability distribution. This book is a valuable contribution to the field of information theory and will be of great interest to any scientist who is interested in IT and in its potential applications
ISBN,Price9783031212765
Keyword(s)1. Chemistry, Physical and theoretical 2. Data structures (Computer science) 3. Data Structures and Information Theory 4. EBOOK - SPRINGER 5. INFORMATION THEORY 6. PROBABILITIES 7. PROBABILITY THEORY 8. STATISTICAL MECHANICS 9. THEORETICAL CHEMISTRY 10. THERMODYNAMICS
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7.     
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TitleProceedings of the 7th International Conference on the Applications of Science and Mathematics 2021 : Sciemathic 2021
Author(s)Mustapha, Aida Binti;Shamsuddin, Suhadir;Zuhaib Haider Rizvi, Syed;Asman, Saliza Binti;Jamaian, Siti Suhana
PublicationSingapore, 1. Imprint: Springer 2. Springer Nature Singapore, 2022.
DescriptionXXVI, 464 p. 212 illus., 167 illus. in color : online resource
Abstract NoteThis book presents peer-reviewed articles and recent advances on the potential applications of Science and Mathematics for future technologies, from the 7th International Conference on the Applications of Science and Mathematics (SCIEMATHIC 2021), held in Malaysia. It provides an insight about the leading trends in sustainable Science and Technology. The world is looking for sustainable solutions to problems more than ever. The synergistic approach of mathematicians, scientists and engineers has undeniable importance for future technologies. With this viewpoint, SCIEMATHIC 2021 has the theme ???Quest for Sustainable Science and Mathematics for Future Technologies???. The conference brings together physicists, mathematicians, statisticians and data scientists, providing a platform to find sustainable solutions to major problems around us. The works presented here are suitable for professionals and researchers globally in making the world a better and sustainable place
ISBN,Price9789811689031
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK 3. EBOOK - SPRINGER 4. MATERIALS SCIENCE 5. Mathematical Modeling and Industrial Mathematics 6. MATHEMATICAL MODELS 7. MATHEMATICAL PHYSICS 8. Statistical Theory and Methods 9. Statistics?? 10. Sustainability 11. THEORETICAL CHEMISTRY
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8.     
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TitleSingle Molecule Toroics : Synthetic Strategies, Theory and Applications
Author(s)Murray, Keith
PublicationCham, 1. Imprint: Springer 2. Springer International Publishing, 2022.
DescriptionXII, 236 p. 106 illus. in color : online resource
Abstract NoteThis book consists of chapters written by international experts on various aspects of single molecule toroics (SMTs).The chapters cover a broad range of relevant topics and highlight the latest advances performed in the field. An up-to-date overview of the emerging SMT architectures is presented while particular attention is given to not only the magnetism and relaxation effects involved but also to the respective applications in advanced electronics and memory devices. The role that lanthanides play -especially that of dysprosium- is discussed, while a thorough analysis using theoretical/ab initio calculations is provided. Since SMTs have grown out of single molecule magnetism (SMM), it is an expanding and topical subject and the present book will engender excitement and interest amongst chemists, physicists, theoreticians and materials scientists. The volume will be of great interest to researchers and graduates working on this topic and particularly those involved in lanthanide chemistry, magnetism and theory.
ISBN,Price9783031117091
Keyword(s)1. CHEMISTRY 2. Chemistry, Physical and theoretical 3. CONDENSED MATTER 4. CONDENSED MATTER PHYSICS 5. Coordination Chemistry 6. Coordination compounds 7. EBOOK 8. EBOOK - SPRINGER 9. MAGNETISM 10. MATERIALS 11. Materials Chemistry 12. THEORETICAL CHEMISTRY
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9.     
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TitleMemory Functions, Projection Operators, and the Defect Technique : Some Tools of the Trade for the Condensed Matter Physicist
Author(s)Kenkre, V. M. (Nitant)
PublicationCham, Springer International Publishing, 2021.
DescriptionXXII, 374 p. 83 illus., 2 illus. in color : online resource
Abstract NoteThis book provides a graduate-level introduction to three powerful and closely related techniques in condensed matter physics: memory functions, projection operators, and the defect technique. Memory functions appear in the formalism of the generalized master equations that express the time evolution of probabilities via equations non-local in time, projection operators allow the extraction of parts of quantities, such as the diagonal parts of density matrices in statistical mechanics, and the defect technique allows solution of transport equations in which the translational invariance is broken in small regions, such as when crystals are doped with impurities. These three methods combined form an immensely useful toolkit for investigations in such disparate areas of physics as excitation in molecular crystals, sensitized luminescence, charge transport, non-equilibrium statistical physics, vibrational relaxation, granular materials, NMR, and even theoretical ecology. This book explains the three techniques and their interrelated nature, along with plenty of illustrative examples. Graduate students beginning to embark on a research project in condensed matter physics will find this book to be a most fruitful source of theoretical training.
ISBN,Price9783030686673
Keyword(s)1. Chemistry, Physical and theoretical 2. CONDENSED MATTER 3. CONDENSED MATTER PHYSICS 4. EBOOK 5. EBOOK - SPRINGER 6. Mathematical Methods in Physics 7. MATHEMATICAL PHYSICS 8. OPERATOR THEORY 9. STATISTICAL PHYSICS 10. THEORETICAL CHEMISTRY
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10.    
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TitleFrom Chemistry to Consciousness : The Legacy of Hans Primas
Author(s)Atmanspacher, Harald;M??ller-Herold, Ulrich
PublicationCham, Springer International Publishing, 2016.
DescriptionXII, 154 p. 26 illus., 11 illus. in color : online resource
Abstract NoteThis book reflects on the significant and highly original scientific contributions of Hans Primas. A professor of chemistry at ETH Zurich from 1962 to 1995, Primas continued his research activities until his death in 2014. Over these 50 years and more, he worked on the foundations of nuclear magnetic resonance spectroscopy, contributed to a number of significant issues in theoretical chemistry, helped to clarify central topics in quantum theory and the philosophy of physics, suggested innovative ways of addressing interlevel relations in the philosophy of science, and introduced cutting-edge approaches in the flourishing young field of scientific studies of consciousness. His work in these areas of research and its continuing impact is described by noted experts, colleagues, and collaborators of Primas. All authors contextualize their contributions to facilitate the mutual dialog between these fields
ISBN,Price9783319435732
Keyword(s)1. Chemistry, Physical and theoretical 2. Cognitive psychology 3. EBOOK 4. EBOOK - SPRINGER 5. History and Philosophical Foundations of Physics 6. NUCLEAR CHEMISTRY 7. PHYSICS 8. QUANTUM PHYSICS 9. Theoretical and Computational Chemistry
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