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Molecular Modelling and Synthesis of Nanomaterials: Applications in Carbon- And Boron-Based Nanotechnology, Boustani Ihsan


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Автор: Boustani Ihsan
Название:  Molecular Modelling and Synthesis of Nanomaterials: Applications in Carbon- And Boron-Based Nanotechnology
ISBN: 9783030327255
Издательство: Springer
Классификация:



ISBN-10: 3030327256
Обложка/Формат: Hardcover
Страницы: 594
Вес: 1.02 кг.
Дата издания: 15.07.2020
Серия: Springer series in materials science
Язык: English
Издание: 1st ed. 2020
Иллюстрации: 100 tables, color; 394 illustrations, color; 145 illustrations, black and white; xiii, 594 p. 539 illus., 394 illus. in color.
Размер: 23.39 x 15.60 x 3.33 cm
Читательская аудитория: Professional & vocational
Подзаголовок: Applications in carbon- and boron-based nanotechnology
Ссылка на Издательство: Link
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Поставляется из: Германии
Описание: ForewordPrefaceI Molecular Modelling & Magic Clusters1. Molecular Modelling1.1. Concepts of Molecular Modelling1.1.1. Areas of Molecular Modelling1.1.2. The Basics of Molecular Modelling1.2. Molecular Mechanics1.2.1. Force Field Equation1.2.2. Minimization Procedure1.2.3. Optimization Methods1.2.4. Gradient Methods1.2.5. General Newton-Raphson Method1.3. Molecular Dynamics1.3.1. Trajectory and Equation of Motion1.3.2. Initialization of Positions and Velocities1.3.3. Verlet Algorithm1.3.4. Leap-Frog Algorithm1.4. Ab Initio Quantum Chemical Methods1.4.1. Some Basics of Quantum Mechanics1.4.2. The Hamiltonian1.4.3. Time-dependent Schrцdinger Equation1.4.4. Hartree-Fock Theory1.4.5. Post Hartree-Fock1.5. Density Functional Theory1.5.1. Kohn-Sham Equations1.5.2. Local (Spin) Density Approximation1.5.3. Non-Local Density-Gradient Corrections1.5.4. Hybrid Functionals1.5.5. Chemistry Software2. Magic Numbers & Clusters2.1. Atomic Clusters and Magic Numbers2.2. What are Orbitals and Shells2.2.1. The Structure of Atom2.2.2. Shell Structure of Nucleons2.2.3. Shell Structure of Condensed Clusters2.2.4. Shell Structure of Hollow Clusters2.3. Magic Numbers in Nature2.3.1. Magic Numbers of Electron Shells2.3.2. Magic Numbers of Nuclear Shells2.3.3. Magic Electronic Shells of Clusters2.3.4. Magic Filled Shells of Clusters2.3.5. Magic Hollow Shells of Clusters2.3.6. Magnetic Shells of Electrons3. Alkali Metal Clusters3.1. Alkali Metals3.2. Lithium Metal Clusters3.2.1. Production of Metal Clusters3.2.2. Lithium Atom3.2.3. Lithium Clusters3.2.4. Experimental Evidence3.2.5. Lin Clusters For n 3.2.6. Lin Clusters For n 3.2.7. Lin Clusters For n 3.2.8. Lin Clusters For n 3.3. Sodium Metal Clusters3.3.1. Sodium Atom3.3.2. Sodium Clusters3.3.3. First Study on Small Na Clusters3.3.4. Electronic Shells of Na Clusters3.3.5. Jellium Model for Na Clusters3.3.6. Mass Spectra of Na Clusters3.4. Geometrical Structures of Nan Clusters3.4.1. Nan Clusters for n 3.4.2. The Structure of the Magic Cluster Na83.4.3. Raman Spectra of the Magic Cluster Na83.4.4. Basics of Photoabsorption3.4.5. Nan Clusters for 33.4.6. Nan Clusters for 93.4.7. Nan Clusters for 13II The p-Block Non-Metal Clusters4. The Element Boron4.0.1. History of Boron4.0.2. Energetic Boron4.0.3. Boron Materials4.0.4. Chemistry of Boron4.1. Icosahedral-Based Crystalline Boron4.1.1. First Crystalline4.1.2. Rhombohedral Boron4.1.3. Orthorhombic & Tetragonal Boron4.2. Non-icosahedral Boron Clusters Bn (2 4.2.1. Small Boron clusters4.2.2. Prediction of Planarity & Aufbau Principle4.2.3. Theoretical Confirmations4.2.4. Experimental Confirmations4.2.5. Hydrocarbon and Boron Clusters4.2.6. Coulomb Explosion4.3. Neutral and Charged Boron Clusters Bn (n 4.3.1. Boron Clusters Bn (15 4.3.2. Boron Clusters Bn (26 4.3.3. Boron Clusters Bn (37 4.4. The Largest Predicted Quasi-Planar Cluster B845. The Element


Nanotubes and nanosheets: functionalization and applications of boron nitride and other nanomaterials

Автор: Chen Y.
Название: Nanotubes and nanosheets: functionalization and applications of boron nitride and other nanomaterials
ISBN: 1466598093 ISBN-13(EAN): 9781466598096
Издательство: Taylor&Francis
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Цена: 29093.00 р.
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Описание:

Reveals Innovative Research on BN Nanotubes and Nanosheets

Nanotubes and Nanosheets: Functionalization and Applications of Boron Nitride and Other Nanomaterials is the first book devoted to nanotubes and nanosheets made of boron nitride (BN). It shows how the properties of BN nanotubes and nanosheets have led to many exciting applications where carbon (C) materials cannot be used, including high-temperature metal-ceramic-based composites, substrates for graphene and other semiconducting layers in electronic devices, reusable absorbents for oil and other contaminants, dry solid lubricants, and biomedical applications.

Researchers working on various aspects of BN nanomaterials share their knowledge and current work on the applications of BN nanotubes and nanosheets. They describe numerous applications, including BN nanotube-reinforced metal-ceramic-based composites, field emission, desalination, cleanup of oil spillages, biosensing and bioimaging, drug delivery, biomedical applications, and energy storage using BCN and TiO2 nanorods and nanosheets as electrode materials. The book also covers C and other nanotubes and nanosheets to give readers a broad view of the latest nanomaterials research.

2D Boron: Boraphene, Borophene, Boronene

Автор: Matsuda Iwao, Wu Kehui
Название: 2D Boron: Boraphene, Borophene, Boronene
ISBN: 3030499987 ISBN-13(EAN): 9783030499983
Издательство: Springer
Цена: 20962.00 р.
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Описание: This book addresses the development, properties, and applications of atomic-layered boron, or, borophene. The authors explain how borophene was predicted and created before investigating the properties that make it a desirable and useful material.

Environmental Applications Of Nanomaterials: Synthesis, Sorbents And Sensors (2Nd Edition)

Автор: Fryxell Glen E Et Al
Название: Environmental Applications Of Nanomaterials: Synthesis, Sorbents And Sensors (2Nd Edition)
ISBN: 1848168039 ISBN-13(EAN): 9781848168039
Издательство: World Scientific Publishing
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Цена: 38016.00 р.
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Описание: Deals with functional nanomaterials, materials containing specific, predictable nanostructures whose chemical composition or interfacial structure enables to perform a specific job. This book addresses some of the environmental remediation and sensing/detection problems faced by mankind.

Synthesis And Applications Of Optically Active Nanomaterials

Автор: Fan Hongyou, Bai Feng
Название: Synthesis And Applications Of Optically Active Nanomaterials
ISBN: 9813222980 ISBN-13(EAN): 9789813222984
Издательство: World Scientific Publishing
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Цена: 12197.00 р.
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Описание:

In this book, the synthesis and applications of recent nanomaterials are discussed and reviewed in detail. The scope of the book covers from nanocrystals and their self-assembly, synthesis and applications of optically active porphyrin particles, and synthesis and applications of carbon nanodots. Depending on the categories of the materials, detailed driving forces to self-assembly of the cluster or arrays are discussed. Finally, major applications of each category nanomaterial are discussed.

Nanomaterials discussed in this book are important building blocks for nanoelectronic and nanophotonic device fabrications. Methods to synthesize and functionalize them are crucial to enable their applications in these areas. This book provides readers with detailed description and discussions on synthesis and functionalization of recent optically active nanomaterials. This book is an important tool for researchers in the nanomaterial field. It will be also a great reference for college students to master overall knowledge in the field.

Near-Infrared Nanomaterials: Preparation, Bioimaging and Therapy Applications

Название: Near-Infrared Nanomaterials: Preparation, Bioimaging and Therapy Applications
ISBN: 1782623191 ISBN-13(EAN): 9781782623199
Издательство: Royal Society of Chemistry
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Цена: 37805.00 р.
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Описание: This book systematically summarises the recent progress in the fabrication and application of near infrared nanomaterials for biomedical imaging and therapy.

Inorganic Two-Dimensional Nanomaterials: Fundamental Understanding, Characterizations and Energy Applications

Автор: Changzheng Wu
Название: Inorganic Two-Dimensional Nanomaterials: Fundamental Understanding, Characterizations and Energy Applications
ISBN: 1782624651 ISBN-13(EAN): 9781782624653
Издательство: Royal Society of Chemistry
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Цена: 37805.00 р.
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Описание: Inorganic Two-Dimensional Nanomaterials provides an overview of the development on inorganic two-dimensional nanomaterials from computational simulation and theoretical understanding to applications in energy conversion and storage.

Carbon Nanomaterials: Modeling, Design, and Applications

Автор: Kun Zhou
Название: Carbon Nanomaterials: Modeling, Design, and Applications
ISBN: 0815357842 ISBN-13(EAN): 9780815357841
Издательство: Taylor&Francis
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Цена: 28327.00 р.
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Описание: Carbon Nanomaterials: Modeling, Design, and Applications provides an in-depth review and analysis of the most important carbon nanomaterials, including fullerenes, carbon nanotubes, graphene and novel carbon nanomaterial-based membranes and thin films, with an emphasis on modeling, design and applications.

Synthesis, Technology and Applications of Carbon Nanomaterials

Автор: Rashid, Suraya Abdul
Название: Synthesis, Technology and Applications of Carbon Nanomaterials
ISBN: 0128157577 ISBN-13(EAN): 9780128157572
Издательство: Elsevier Science
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Цена: 26107.00 р.
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Описание:

Synthesis, Technology and Applications of Carbon Nanomaterials explores the chemical properties of different classes of carbon nanomaterials and their major applications. As carbon nanomaterials are used for a variety of applications due to their versatile properties and characteristics, this book discusses recent advances in synthesis methods, characterization, and applications of 0D -3D dimensional carbon nanomaterials. It is an essential resource for readers focusing on carbon nanomaterials research.

  • Explores the chemical properties of different classes of carbon nanomaterials and their major applications
  • Discusses recent advances in synthesis methods, characterization, and applications of 0D -3D dimensional carbon nanomaterials
Black Tio2 Nanomaterials For Energy Applications

Автор: Chen Xiaobo Et Al
Название: Black Tio2 Nanomaterials For Energy Applications
ISBN: 1786341654 ISBN-13(EAN): 9781786341655
Издательство: World Scientific Publishing
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Цена: 17741.00 р.
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Описание: The transformation of titanium dioxide (TiO2) nanomaterials from white to black using disorder engineering has meant a dramatic increase in their performance in photocatalytic experiments.

Environmental Applications of Nanomaterials

Автор: Fryxell, G.E.
Название: Environmental Applications of Nanomaterials
ISBN: 1848168047 ISBN-13(EAN): 9781848168046
Издательство: World Scientific Publishing
Рейтинг:
Цена: 12989.00 р.
Наличие на складе: Есть у поставщика Поставка под заказ.

Описание: Deals with functional nanomaterials, materials containing specific, predictable nanostructures whose chemical composition or interfacial structure enables to perform a specific job. This book addresses some of the environmental remediation and sensing/detection problems faced by mankind.

Nanocomposites, Nanostructures, and Their Applications: Selected Proceedings of the 6th International Conference Nanotechnology and Nanomaterials (Nan

Автор: Fesenko Olena, Yatsenko Leonid
Название: Nanocomposites, Nanostructures, and Their Applications: Selected Proceedings of the 6th International Conference Nanotechnology and Nanomaterials (Nan
ISBN: 3030177610 ISBN-13(EAN): 9783030177614
Издательство: Springer
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Цена: 19564.00 р.
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Silica-based organic-inorganic hybrid nanomaterials: synthesis, functionalization and applications in the field of catalysis

Автор: Sharma, Rakesh Kumar (univ Of Delhi, India) Monga, Yukti (univ Of Delhi, India) Sharma, Shivani (univ Of Delhi, India) Yadav, Manavi (univ Of Delhi, I
Название: Silica-based organic-inorganic hybrid nanomaterials: synthesis, functionalization and applications in the field of catalysis
ISBN: 1786347466 ISBN-13(EAN): 9781786347466
Издательство: World Scientific Publishing
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Цена: 14256.00 р.
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Описание: Currently the field of nanocatalysis is undergoing many exciting developments and the design of silica-based organic-inorganic hybrid nanocatalysts is a key focus of the researchers working in this field.This book aims to present a succinct overview of the recent research progress directed towards the fabrication of silica-based organic-inorganic hybrid catalytic systems encompassing the key advantages of silica nanoparticles and silica-coated magnetic nanoparticles in an integrated manner. Featuring comprehensive descriptions of almost all approaches utilized for the synthesis of nanomaterials including some latest techniques such as flow and microwave-assisted synthesis that enable large-scale synthesis, it proves useful not only to academics but also industrialists. It also includes a systematic discussion on the vital characterization techniques employed for authenticating the structure of these.The title also offers an enormous amount of knowledge about the fusion of nanotechnology with green chemistry that strives to meet the scientific challenges of protecting human health and the environment.


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