Electronic Structure of Quantum Confined Atoms and Molecules

Electronic Structure of Quantum Confined Atoms and Molecules PDF Author: K.D. Sen
Publisher: Springer
ISBN: 3319099825
Category : Science
Languages : en
Pages : 260

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Book Description
The present volume is a collection of review articles highlighting the fundamental advances made in this area by the internationally acclaimed research groups , most of them being pioneers themselves and coming together for the first time.

Electronic Structure of Quantum Confined Atoms and Molecules

Electronic Structure of Quantum Confined Atoms and Molecules PDF Author: K.D. Sen
Publisher: Springer
ISBN: 3319099825
Category : Science
Languages : en
Pages : 260

Get Book Here

Book Description
The present volume is a collection of review articles highlighting the fundamental advances made in this area by the internationally acclaimed research groups , most of them being pioneers themselves and coming together for the first time.

Quantum Dot Molecules

Quantum Dot Molecules PDF Author: Jiang Wu
Publisher: Springer Science & Business Media
ISBN: 1461481309
Category : Technology & Engineering
Languages : en
Pages : 383

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Book Description
A quantum dot molecule (QDM) is composed of two or more closely spaced quantum dots or “artificial atoms.” In recent years, QDMs have received much attention as an emerging new artificial quantum system. The interesting and unique coupling and energy transfer processes between the “artificial atoms” could substantially extend the range of possible applications of quantum nanostructures. This book reviews recent advances in the exciting and rapidly growing field of QDMs via contributions from some of the most prominent researchers in this scientific community. The book explores many interesting topics such as the epitaxial growth of QDMs, spectroscopic characterization, and QDM transistors, and bridges between the fundamental physics of novel materials and device applications for future information technology. Both theoretical and experimental approaches are considered. Quantum Dot Molecules can be recommended for electrical engineering and materials science department courses on the science and design of advanced and future electronic and optoelectronic devices.

State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More

State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More PDF Author:
Publisher: Academic Press
ISBN: 0128161752
Category : Science
Languages : en
Pages : 362

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Book Description
State of the Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More, Volume 79 in the Advances in Quantum Chemistry series, presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology. Chapters in this new release include Computing accurate molecular properties in real space using multiresolution analysis, Self-consistent electron-nucleus cusp correction for molecular orbitals, Correlated methods for computational spectroscopy, Potential energy curves for the NaH molecule and its cation with the cock space coupled cluster method, and much more. - Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology - Features detailed reviews written by leading international researchers

Colloidal Quantum Dot Optoelectronics and Photovoltaics

Colloidal Quantum Dot Optoelectronics and Photovoltaics PDF Author: Gerasimos Konstantatos
Publisher: Cambridge University Press
ISBN: 0521198267
Category : Science
Languages : en
Pages : 329

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Book Description
Captures the most up-to-date research in the field, written in an accessible style by the world's leading experts.

Semiconductor Quantum Dots

Semiconductor Quantum Dots PDF Author: Ladislaus Alexander Banyai
Publisher: World Scientific
ISBN: 9814504238
Category : Science
Languages : en
Pages : 264

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Book Description
Semiconductor Quantum Dots presents an overview of the background and recent developments in the rapidly growing field of ultrasmall semiconductor microcrystallites, in which the carrier confinement is sufficiently strong to allow only quantized states of the electrons and holes. The main emphasis of this book is the theoretical analysis of the confinement induced modifications of the optical and electronic properties of quantum dots in comparison with extended materials. The book develops the theoretical background material for the analysis of carrier quantum-confinement effects, introduces the different confinement regimes for relative or center-of-mass motion quantization of the electron-hole-pairs, and gives an overview of the best approximation schemes for each regime. A detailed discussion of the carrier states in quantum dots is presented and surface polarization instabilities are analyzed, leading to the self-trapping of carriers near the surface of the dots. The influence of spin-orbit coupling on the quantum-confined carrier states is discussed. The linear and nonlinear optical properties of small and large quantum dots are studied in detail and the influence of the quantum-dot size distribution in many realistic samples is outlined. Phonons in quantum dots as well as the influence of external electric or magnetic fields are also discussed. Last but not least the recent developments dealing with regular systems of quantum dots are also reviewed. All things included, this is an important piece of work on semiconductor quantum dots not to be dismissed by serious researchers and physicists.

Computational Methods for the Description of Intermolecular Interactions and Molecular Motion in Confining Environments

Computational Methods for the Description of Intermolecular Interactions and Molecular Motion in Confining Environments PDF Author: Heribert Reis
Publisher: Frontiers Media SA
ISBN: 2889764109
Category : Science
Languages : en
Pages : 130

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Book Description


Chemical Reactivity in Confined Systems

Chemical Reactivity in Confined Systems PDF Author: Pratim Kumar Chattaraj
Publisher: John Wiley & Sons
ISBN: 1119683238
Category : Science
Languages : en
Pages : 451

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Book Description
An insightful analysis of confined chemical systems for theoretical and experimental scientists Chemical Reactivity in Confined Systems: Theory and Applications presents a theoretical basis for the molecular phenomena observed in confined spaces. The book highlights state-of-the-art theoretical and computational approaches, with a focus on obtaining physically relevant clarification of the subject to enable the reader to build an appreciation of underlying chemical principles. The book includes real-world examples of confined systems that highlight how the reactivity of atoms and molecules change upon encapsulation. Chapters include discussions on recent developments related to several host-guest systems, including cucurbit[n]uril, ExBox+4, clathrate hydrates, octa acid cavitand, metal organic frameworks (MOFs), covalent organic frameworks (COFs), zeolites, fullerenes, and carbon nanotubes. Readers will learn how to carry out new calculations to understand the physicochemical behavior of confined quantum systems. Topics covered include: A thorough introduction to global reactivity descriptors, including electronegativity, hardness, and electrophilicity An exploration of the Fukui function, as well as dual descriptors, higher order derivatives, and reactivity through information theory A practical discussion of spin dependent reactivity and temperature dependent reactivity Concise treatments of population analysis, reaction force, electron localization functions, and the solvent effect on reactivity Perfect for academic researchers and graduate students in theoretical and computational chemistry and confined chemical systems, Chemical Reactivity in Confined Systems: Theory and Applications will also earn a place in the libraries of professionals working in the areas of catalysis, supramolecular chemistry, and porous materials.

Ideas of Quantum Chemistry

Ideas of Quantum Chemistry PDF Author: Lucjan Piela
Publisher: Elsevier
ISBN: 0080466761
Category : Science
Languages : en
Pages : 1122

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Book Description
Ideas of Quantum Chemistry shows how quantum mechanics is applied to chemistry to give it a theoretical foundation. The structure of the book (a TREE-form) emphasizes the logical relationships between various topics, facts and methods. It shows the reader which parts of the text are needed for understanding specific aspects of the subject matter. Interspersed throughout the text are short biographies of key scientists and their contributions to the development of the field.Ideas of Quantum Chemistry has both textbook and reference work aspects. Like a textbook, the material is organized into digestable sections with each chapter following the same structure. It answers frequently asked questions and highlights the most important conclusions and the essential mathematical formulae in the text. In its reference aspects, it has a broader range than traditional quantum chemistry books and reviews virtually all of the pertinent literature. It is useful both for beginners as well as specialists in advanced topics of quantum chemistry. The book is supplemented by an appendix on the Internet.* Presents the widest range of quantum chemical problems covered in one book * Unique structure allows material to be tailored to the specific needs of the reader * Informal language facilitates the understanding of difficult topics

Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - Part A

Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - Part A PDF Author:
Publisher: Academic Press
ISBN: 0128028688
Category : Science
Languages : en
Pages : 399

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Book Description
This volume presents a series of articles concerning current important topics in quantum chemistry. - Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology - Features detailed reviews written by leading international researchers

Molecular Quantum Mechanics

Molecular Quantum Mechanics PDF Author: Peter W. Atkins
Publisher: Oxford University Press
ISBN: 0199541426
Category : Science
Languages : en
Pages : 552

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Book Description
This text unravels those fundamental physical principles which explain how all matter behaves. It takes us from the foundations of quantum mechanics, through quantum models of atomic, molecular, and electronic structure, and on to discussions of spectroscopy, and the electronic and magnetic properties of molecules.