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31 Larson, Jonas Conical Intersections in Physics I08795 2020 eBook  
32 Kasai, Hideaki Hydrogen and Hydrogen-Containing Molecules on Metal Surfaces I08725 2020 eBook  
33 Vainshtein, Boris K Modern Crystallography 2 I11538 2000 eBook  
34 Marchildon, Louis Quantum Mechanics I11455 2002 eBook  
35 Emmerich, Heike The Diffuse Interface Approach in Materials Science I11360 2003 eBook  
36 Morawiec, Adam Orientations and Rotations I11250 2004 eBook  
37 Fiolhais, Carlos A Primer in Density Functional Theory I11245 2003 eBook  
38 Patil, S.H Asymptotic Methods in Quantum Mechanics I11136 2000 eBook  
39 Schwabl, Franz Advanced Quantum Mechanics I11113 2004 eBook  
40 Schwabl, Franz Quantum Mechanics I11069 2002 eBook  
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31.    
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TitleConical Intersections in Physics : An Introduction to Synthetic Gauge Theories
Author(s)Larson, Jonas;Erik Sjoqvist;Patrik Ohberg
PublicationCham, Springer International Publishing, 2020.
DescriptionXIII, 160 p. 57 illus., 34 illus. in color : online resource
Abstract NoteThis concise book introduces and discusses the basic theory of conical intersections with applications in atomic, molecular and condensed matter physics. Conical intersections are linked to the energy of quantum systems. They can occur in any physical system characterized by both slow and fast degrees of freedom - such as e.g. the fast electrons and slow nuclei of a vibrating and rotating molecule - and are important when studying the evolution of quantum systems controlled by classical parameters. Furthermore, they play a relevant role for understanding the topological properties of condensed matter systems. Conical intersections are associated with many interesting features, such as a breakdown of the Born-Oppenheimer approximation and the appearance of nontrivial artificial gauge structures, similar to the Aharonov-Bohm effect. Some applications presented in this book include - Molecular Systems: some molecules in nonlinear nuclear configurations undergo Jahn-Teller distortions under which the molecule lower their symmetry if the electronic states belong to a degenerate irreducible representation of the molecular point group. - Solid State Physics: different types of Berry phases associated with conical intersections can be used to detect topologically nontrivial states of matter, such as topological insulators, Weyl semi-metals, as well as Majorana fermions in superconductors. - Cold Atoms: the motion of cold atoms in slowly varying inhomogeneous laser fields is governed by artificial gauge fields that arise when averaging over the fast internal degrees of freedom of the atoms. These gauge fields can be Abelian or non-Abelian, which opens up the possibility to create analogs to various relativistic effects at low speed
ISBN,Price9783030348823
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK 3. EBOOK - SPRINGER 4. QUANTUM OPTICS 5. QUANTUM PHYSICS 6. SOLID STATE PHYSICS 7. Theoretical and Computational Chemistry
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32.     
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TitleHydrogen and Hydrogen-Containing Molecules on Metal Surfaces : Towards the Realization of Sustainable Hydrogen Economy
Author(s)Kasai, Hideaki;Padama, Allan Abraham B;Chantaramolee, Bhume;Arevalo, Ryan L
PublicationSingapore, Springer Singapore, 2020.
DescriptionXVI, 151 p. 98 illus., 53 illus. in color : online resource
Abstract NoteThis book is dedicated to recent advancements in theoretical and computational studies on the interactions of hydrogen and hydrogenated molecules with metal surfaces. These studies are driven by the development of high-performance computers, new experimental findings, and the extensive work of technological applications toward the realization of sustainable hydrogen economy. Understanding of the elementary processes of the physical and chemical reactions on the atomic scale is important in pursuing materials with high chemical reactivity and catalytic activity as well as high stability and durability. From this point of view, the book focuses on the behavior of hydrogen and hydrogenated molecules on flat, stepped, and reconstructed metal surfaces. It also tackles quantum mechanical properties of hydrogen and related adsorbates such as the molecular orbital angular momentum (spin) and diffusion along the minimum potential energy landscape on metal surfaces. All of these have been found to profoundly influence the outcomes of (1) catalytic reactions that involve hydrogen; (2) hydrogen storage in metals; and (3) hydrogen purification membranes. Lastly, it surveys the current status of the technology, outlook, and challenges for the long-desired sustainable hydrogen economy in relation to the topics covered in the book.
ISBN,Price9789811569944
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK 3. EBOOK - SPRINGER 4. Energy Materials 5. FORCE AND ENERGY 6. Interfaces (Physical sciences) 7. MATERIALS SCIENCE 8. Materials???Surfaces 9. Surface and Interface Science, Thin Films 10. Surfaces (Physics) 11. Surfaces and Interfaces, Thin Films 12. Theoretical and Computational Chemistry 13. THIN FILMS
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I08725     On Shelf    

33.     
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TitleModern Crystallography 2 : Structure of Crystals
Author(s)Vainshtein, Boris K;Fridkin, Vladimir M;Indenbom, Vladimir L
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2000.
DescriptionXX, 521 p : online resource
Abstract NoteStructure of Crystals describes the ideal and real atomic structure of crystals as well as the electronic structures. The fundamentals of chemical bonding between atoms are given, and the geometric representations in the theory of crystal structure and crystal chemistry, as well as the lattice energy, are considered. The important classes of crystal structures in inorganic compounds as well as the structures of polymers, liquid crystals, biological crystals, and macromolecules are treated. This edition is complemented with recent data on many types of crystal structures - e.g., the structure of fullerenes, high-temperature superconductors, minerals, and liquid crystals
ISBN,Price9783642572548
Keyword(s)1. Atomic, Molecular, Optical and Plasma Physics 2. ATOMS 3. Biological and Medical Physics, Biophysics 4. BIOLOGICAL PHYSICS 5. BIOPHYSICS 6. Chemistry, Physical and theoretical 7. CRYSTALLOGRAPHY 8. Crystallography and Scattering Methods 9. EBOOK 10. EBOOK - SPRINGER 11. ENGINEERING 12. Engineering, general 13. MINERALOGY 14. PHYSICS 15. Theoretical and Computational Chemistry
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I11538     On Shelf    

34.     
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TitleQuantum Mechanics : From Basic Principles to Numerical Methods and Applications
Author(s)Marchildon, Louis
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2002.
DescriptionXVI, 560 p : online resource
Abstract NoteThis advanced text develops first the underlying concepts of quantum mechanics, thus starting with state spaces of finite dimension followed by the representation of coordinates with their principal formal elements, and their applications such as the harmonic oscillator, magnetic momentum, the hydrogen atom, stationary perturbations etc. This fresh and original text on quantum mechanics focuses on: the development of numerical methods for obtaining specific results; the presentation of group theory and the systematic use of operators; the introduction of the functional integral and its applications in approximation; the discussion of distant correlations and experimental measurements. Numerous exercises with hints and solutions, examples and applications, and a guide to key references help the student to work with the text
ISBN,Price9783662047507
Keyword(s)1. Atomic structure???? 2. Atomic/Molecular Structure and Spectra 3. Chemistry, Physical and theoretical 4. EBOOK 5. EBOOK - SPRINGER 6. Elementary particles (Physics) 7. Elementary Particles, Quantum Field Theory 8. Molecular structure?? 9. QUANTUM FIELD THEORY 10. QUANTUM PHYSICS 11. Theoretical and Computational Chemistry
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35.     
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TitleThe Diffuse Interface Approach in Materials Science : Thermodynamic Concepts and Applications of Phase-Field Models
Author(s)Emmerich, Heike
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2003.
DescriptionVIII, 180 p : online resource
ISBN,Price9783540364092
Keyword(s)1. Characterization and Evaluation of Materials 2. Chemistry, Physical and theoretical 3. Computational Science and Engineering 4. Computer mathematics 5. CONDENSED MATTER 6. CONDENSED MATTER PHYSICS 7. EBOOK 8. EBOOK - SPRINGER 9. MATERIALS SCIENCE 10. Theoretical and Computational Chemistry 11. THERMODYNAMICS
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I11360     On Shelf    

36.     
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TitleOrientations and Rotations : Computations in Crystallographic Textures
Author(s)Morawiec, Adam
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2004.
DescriptionX, 200 p : online resource
Abstract NoteThe book is about mathematical and computational foundations of texture analysis. Numerical techniques are indispensable in texture analysis, so the book is primarily addressed to researchers and students using these techniques in practice. Orientations and Rotations is very different from other books on textures in its content and focal point. Major part of the book is devoted to orientations and rotations in general. Opening chapters contain an extensive and thorough introduction to rotations in three dimensions (including parameterizations and geometry of the rotation space). Further chapters are also general but they will be of interest for readers dealing with orientations of symmetric objects. This subject is essential for crystallographic textures since most crystal structures are symmetric. The final chapters concern more practical aspects of textures (such as the determination of orientations from diffraction patterns and the calculation of effective elastic properties of polycrystals). The book will be of interest for scientists working on plasticity, grain boundaries, recrystallisation, grain growth, and numerous other issues in which textures must be taken into account. Because of the extensive parts on rotations in general, the book can be valuable for everyone dealing with rotations
ISBN,Price9783662091562
Keyword(s)1. Characterization and Evaluation of Materials 2. Chemistry, Physical and theoretical 3. CRYSTALLOGRAPHY 4. Crystallography and Scattering Methods 5. EBOOK 6. EBOOK - SPRINGER 7. GEOMETRY 8. MATERIALS SCIENCE 9. MINERALOGY 10. Theoretical and Computational Chemistry
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I11250     On Shelf    

37.     
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TitleA Primer in Density Functional Theory
Author(s)Fiolhais, Carlos;Nogueira, Fernando;Marques, Miguel A.L
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2003.
DescriptionXIII, 258 p : online resource
Abstract NoteDensity functional theory (DFT) is by now a well-established method for tackling the quantum mechanics of many-body systems. Originally applied to compute properties of atoms and simple molecules, DFT has quickly become a work horse for more complex applications in the chemical and materials sciences. The present set of lectures, spanning the whole range from basic principles to relativistic and time-dependent extensions of the theory, is the ideal introduction for graduate students or nonspecialist researchers wishing to familiarize themselves with both the basic and most advanced techniques in this field
ISBN,Price9783540370727
Keyword(s)1. Atomic structure???? 2. Atomic/Molecular Structure and Spectra 3. Chemistry, Physical and theoretical 4. CONDENSED MATTER 5. CONDENSED MATTER PHYSICS 6. EBOOK 7. EBOOK - SPRINGER 8. MATHEMATICAL PHYSICS 9. Molecular structure?? 10. QUANTUM PHYSICS 11. Theoretical and Computational Chemistry 12. Theoretical, Mathematical and Computational Physics
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I11245     On Shelf    

38.     
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TitleAsymptotic Methods in Quantum Mechanics : Application to Atoms, Molecules and Nuclei
Author(s)Patil, S.H;Tang, K.T
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2000.
DescriptionXI, 174 p : online resource
Abstract NoteAsymptotic Methods in Quantum Mechanics is a detailed discussion of the general properties of the wave functions of many particle systems. Particular emphasis is placed on their asymptotic behaviour, since the outer region of the wave function is most sensitive to external interaction. The analysis of these local properties helps in constructing simple and compact wave functions for complicated systems. It also helps in developing a broad understanding of different aspects of quantum mechanics. As applications, wave functions with correct asymptotic forms are used to systematically generate a large data base for susceptibilities, polarizabilities, interactomic potentials and nuclear densities of many atomic, molecular and nuclear systems
ISBN,Price9783642573170
Keyword(s)1. ACOUSTICS 2. Atomic, Molecular, Optical and Plasma Physics 3. ATOMS 4. Chemistry, Physical and theoretical 5. EBOOK 6. EBOOK - SPRINGER 7. Elementary particles (Physics) 8. Elementary Particles, Quantum Field Theory 9. Numerical and Computational Physics, Simulation 10. PHYSICS 11. QUANTUM FIELD THEORY 12. QUANTUM PHYSICS 13. Theoretical and Computational Chemistry
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39.     
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TitleAdvanced Quantum Mechanics
Author(s)Schwabl, Franz
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2004.
DescriptionXVII, 406 p : online resource
Abstract NoteAdvanced Quantum Mechanics, the second volume on quantum mechanics by Franz Schwabl, discusses nonrelativistic multi-particle systems, relativistic wave equations and relativistic fields. As expected in Schwabl???s works, the text features a compelling mathematical presentation in which all intermediate steps are derived and where numerous examples for application and exercises help the student to gain a thorough working knowledge of the subject. The treatment of relativistic wave equations and their symmetries and the fundamentals of quantum field theory lay the foundations for advanced studies in solid-state physics, nuclear and elementary particle physics. This text extends and complements Schwabl???s introductory Quantum Mechanics, which covers nonrelativistic quantum mechanics and offers a short treatment of the quantization of the radiation field
ISBN,Price9783662054185
Keyword(s)1. Chemistry, Physical and theoretical 2. EBOOK 3. EBOOK - SPRINGER 4. QUANTUM COMPUTERS 5. Quantum Information Technology, Spintronics 6. QUANTUM PHYSICS 7. SPINTRONICS 8. Theoretical and Computational Chemistry
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I11113     On Shelf    

40.    
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TitleQuantum Mechanics
Author(s)Schwabl, Franz
PublicationBerlin, Heidelberg, Springer Berlin Heidelberg, 2002.
DescriptionXV, 420 p : online resource
Abstract NoteThis introductory course on quantum mechanics is the basic lecture which precedes and completes the author's second book Advanced Quantum Mechanics. The new edition is again up-to-date and has been revised. The book meets the students'needs by giving all mathematical steps, worked examples with applica- tions throughout the text, and many problems at the end of each chapter. It contains nonrelativistic quantum mechanics and a short treatment of the quantization of the radiation field. Besides the essentials, topics such as the theory of measurement, the Bell inequality, decoherence, entanglement and supersymmetric quantum mechanics are discussed. "Any student wishing to develop ma- thematical skills and deepen their understanding of the technical side of quantum theory will find Schwabl's Quantum Mechanics very helpful". #Contemporary Physics#
ISBN,Price9783662048405
Keyword(s)1. Chemistry, Physical and theoretical 2. COMPLEX SYSTEMS 3. DYNAMICAL SYSTEMS 4. EBOOK 5. EBOOK - SPRINGER 6. QUANTUM PHYSICS 7. STATISTICAL PHYSICS 8. Statistical Physics and Dynamical Systems 9. Theoretical and Computational Chemistry
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I11069     On Shelf    

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