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Author: Jerzy Cioslowski
Publisher: Oxford University Press, USA
ISBN:
Category : Literary Criticism
Languages : en
Pages : 310
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Book Description
This book provides a comprehensive overview of the latest approaches to electronic structure calculations of fullerenes. Topics include C(60) and C(70) molecules, the medium-size fullerenes, large carbon clusters, hypothetical allotropic forms of carbon, small fullerenes, endohedral complexes, heterofullerenes, fullerene derivatives, and solid-state fullerenes. A summary of recent research breakthroughs and a discussion of potential future directions round out the book. Far-reaching and well-written, the book will be welcomed by students and researchers in chemistry and quantum physics.
Author: Jerzy Cioslowski
Publisher: Oxford University Press, USA
ISBN:
Category : Literary Criticism
Languages : en
Pages : 310
Get Book Here
Book Description
This book provides a comprehensive overview of the latest approaches to electronic structure calculations of fullerenes. Topics include C(60) and C(70) molecules, the medium-size fullerenes, large carbon clusters, hypothetical allotropic forms of carbon, small fullerenes, endohedral complexes, heterofullerenes, fullerene derivatives, and solid-state fullerenes. A summary of recent research breakthroughs and a discussion of potential future directions round out the book. Far-reaching and well-written, the book will be welcomed by students and researchers in chemistry and quantum physics.
Author: W. Andreoni
Publisher: Springer Science & Business Media
ISBN: 9780792362340
Category : Science
Languages : en
Pages : 474
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Book Description
Krätschmer and Huffman's revolutionary discovery of a new solid phase of carbon, solid C60, in 1990 opened the way to an entire new class of materials with physical properties so diverse that their richness has not yet been fully exploited. Moreover, as a by-product of fullerene research, carbon nanotubes were later identified, from which novel nanostructures originated that are currently fascinating materials scientists worldwide. Rivers of words have been written on both fullerenes and nanotubes, in the form of journal articles, conference proceedings and books. The present book offers, in a concise and self-contained manner, the basics of the science of these materials as well as detailed information on those aspects that have so far been better explored. Structural, electronic and dynamical properties are described as obtained from various measurements and state-of-the-art calculations. Their interrelation emerges as well as their possible dependence on, for example, preparation conditions or methods of investigation. By presenting and comparing data from different sources, experiment and theory, this book helps the reader to rapidly master the basic knowledge, to grasp important issues and critically discuss them. Ultimately, it aims to inspire him or her to find novel ways to approach still open questions. As such, this book is addressed to new researchers in the field as well as experts.
Author: Niny Rao
Publisher:
ISBN:
Category : Electronic structure
Languages : en
Pages : 160
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Book Description
Author: Hisanori Shinohara
Publisher: John Wiley & Sons
ISBN: 1118697928
Category : Technology & Engineering
Languages : en
Pages : 288
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Book Description
Endohedral Metallofullerenes: Fullerenes with Metal Inside presents a comprehensive survey of the current state of knowledge on endohedral metallofullerenes, from preparation to functionalization, reactivity and applications. Following a brief historical overview, the book describes methods for synthesis, extraction, separation and purification, and provides an insight into the molecular and crystal structures. Subsequent chapters discuss various categories of endohedral metallofullerenes based on the encapsulated species, including carbides, nitrides, sulphides, oxides, non-metal and non-IPR endohedral metallofullerenes, followed by scanning tunneling microscopy studies and the examination of electronic, vibrational, magnetic and optical properties. The book concludes with chapters addressing the chemical functionalization of endohedral metallofullerenes, and applications ranging from solar cells to biomedicine.
Author:
Publisher: World Scientific
ISBN: 9814532320
Category : Fullerenes
Languages : en
Pages : 608
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Book Description
Author: B.L. Tumanskii
Publisher: Springer Science & Business Media
ISBN: 0306476347
Category : Science
Languages : en
Pages : 204
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Book Description
The discovery of fullerenes, species belonging to the electronodeficient polyalkenes with weakly conjugated double bonds, has opened novel opportunities for the radical chemistry. Pioneering study in this field was performed by P. J. Krusic, E. Wasserman, P. N. Keizer, J. R. Morton, and K. F. Preston (Science, 1991, 254, 1184). The fullerenyl radical adducts formed via addition of atoms or free radicals to fullerenes have no analogs in organic chemistry. In fact, radicals in which the unpaired electrons are delocalized over the surface of a sphere or ellipsoid have never been studied before. The unusual character of the fullerenyl radicals is also due to the fact that they occupy a sort of intermediate position between the planar and tetrahedral radicals. Thus, the elucidation of the characteristic features of fullerenyl radicals and their reactivity by EPR spectroscopy, and the comparison of the results with those of quantum-chemical studies are of fundamental importance. Isolation of the products from homolytic reactions of fullerenes in bulk amounts opens the door to large-scale preparation of new organic and organoelement derivatives of including biologically active ones. Radical reactions of fullerenes find wide application in the synthesis of fullere- containing polymers with valuable photophysical characteristics. Ferromagnetism of the complex of with tetra(dimethylamino)ethylene found lends impetus to a search of novel methods for preparation of biradicals one unpaired electron of those is located on the fullerene cage while the other retained by the addend.
Author: Oleksandr Loboda
Publisher: Springer Science & Business Media
ISBN: 3642318444
Category : Technology & Engineering
Languages : en
Pages : 161
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Book Description
This book presents theoretical studies of electronic structure, optical and spectroscopic properties of a number of compounds such as porphyrins, fullerenes and heteroatomic single-wall nanotubes. The book presents new, faster calculation methods for application in quantum-chemical theory of electronic structures. It addresses issues of practical importance such as the development of materials for photosensitizers, organic LEDs and solar cells.
Author: Karl M. Kadish
Publisher: John Wiley & Sons
ISBN: 0471290890
Category : Science
Languages : en
Pages : 995
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Book Description
Fullerenes-a guide to the current state of knowledge in the field The last decade has seen an explosion of research into the chemical and physical properties of a promising new class of carbon-based materials known as fullerenes. Karl Kadish and Rodney Ruoff, two highly recognized leaders in the fullerene and nanotube research community, edit a comprehensive and much-needed survey of this important and rapidly evolving field. Contributions by experts in diverse areas of chemistry, physics, pharmacology, materials science, and chemical engineering provide an excellent introduction to fullerenes and highlight their considerable potential in such cutting-edge applications as semiconductor materials, new pharmaceutical compounds, and polymers. From the electrochemistry of fullerenes to molecular and solid C36, this book offers a remarkably fresh and authoritative look at some of the hottest research topics today, including: * Organic functionalization of fullerenes * Photophysical properties of different types of fullerenes * Polyfunctional polymer derivatives of fullerenes * The theory and production of endohedral metallofullerenes * Fullerene surface interactions * Superconductivity in fullerenes * Synthesis of materials incorporated within carbon nanotubes
Author: Ole Krogh Andersen
Publisher: World Scientific
ISBN: 9814583278
Category : Science
Languages : en
Pages : 396
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Book Description
Developments in the density functional theory and the methods of electronic structure calculations have made it possible to carry out ab-initio studies of a variety of materials efficiently and at a predictable level. This book covers many of those state-of-the-art developments and their applications to ordered and disordered materials, surfaces and interfaces and clusters, etc.
Author: Joseph Shinar
Publisher: CRC Press
ISBN: 9780824782573
Category : Science
Languages : en
Pages : 400
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Book Description
This text covers a host of fullerene applications, including nanotubes, compounds of fullerenes with other elements and structures and polymerized fullerenes. It discusses properties of photoexcited states of fullerenes, neutral and charged states, nonlinear optical response (NLO) and electron-electron interactions.
