Interaction-induced Electric Properties of van der Waals Complexes

Interaction-induced Electric Properties of van der Waals Complexes

Author: Victor N. Cherepanov

Publisher: Springer

Published: 2016-11-16

Total Pages: 112

ISBN-13: 331949032X

DOWNLOAD EBOOK

This brief explains the theory of the interaction-induced electrical properties of van der Waals complexes. It focuses on the interaction-induced electrical dipole moments, polarizabilities and first hyperpolarizabilities of atom-atomic, atom-molecular and molecular-molecular van der Waals complexes.


Collision- and Interaction-Induced Spectroscopy

Collision- and Interaction-Induced Spectroscopy

Author: G.C. Tabisz

Publisher: Springer Science & Business Media

Published: 2012-12-06

Total Pages: 581

ISBN-13: 9401101833

DOWNLOAD EBOOK

Collision-or interaction-induced spectroscopy refers to radiative transitions, which are forbidden in free atoms or molecules, but which occur in clusters of interacting atoms or molecules. The most common phenomena are induced absorption, in the infrared region, and induced light scattering, which involves inelastic scattering of visible laser light. The particle interactions giving rise to the necessary induced dipole moments and polarizabilities are modelled at long range by multipole expansions; at short range, electron overlap and exchange mechanisms come into play. Information on atomic and molecular interactions and dynamics in dense media on a picosecond timescale may be drawn from the spectra. Collision-induced absorption in the infrared was discovered at the University of Toronto in 1949 by Crawford, Welsh and Locke who studied liquid O and N. Through the 1950s and 1960s, 2 2 experimental elucidation of the phenomenon, particularly in gases, continued and theoretical underpinnings were established. In the late 1960s, the related phenomenon of collision-induced light scattering was first observed in compressed inert gases. In 1978, an 'Enrico Fermi' Summer School was held at Varenna, Italy, under the directorship of J. Van Kranendonk. The lectures, there, reviewed activity from the previous two decades, during which the approach to the subject had not changed greatly. In 1983, a highly successful NATO Advanced Research Workshop was held at Bonas, France, under the directorship of G. Birnbaum. An important outcome of that meeting was the demonstration of the maturity and sophistication of current experimental and theoretical techniques.


International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2004)

International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2004)

Author: Theodore Simos

Publisher: CRC Press

Published: 2019-04-29

Total Pages: 1192

ISBN-13: 1482284200

DOWNLOAD EBOOK

The International Conference of Computational Methods in Sciences and Engineering (ICCMSE) is unique in its kind. It regroups original contributions from all fields of the traditional Sciences, Mathematics, Physics, Chemistry, Biology, Medicine and all branches of Engineering. The aim of the conference is to bring together computational scientists from several disciplines in order to share methods and ideas. More than 370 extended abstracts have been submitted for consideration for presentation in ICCMSE 2004. From these, 289 extended abstracts have been selected after international peer review by at least two independent reviewers.


Molecular Materials with Specific Interactions - Modeling and Design

Molecular Materials with Specific Interactions - Modeling and Design

Author: W. Andrzej Sokalski

Publisher: Springer Science & Business Media

Published: 2007-05-06

Total Pages: 597

ISBN-13: 140205372X

DOWNLOAD EBOOK

Design of new molecular materials is emerging as a new interdisciplinary research field. Corresponding reports are scattered in literature, and this book constitutes one of the first attempts to overview ongoing research efforts. It provides basic information, as well as the details of theory and examples of its application, to experimentalists and theoreticians interested in modeling molecular properties and putting into practice rational design of new materials.


Chemical Modelling

Chemical Modelling

Author: Michael Springborg

Publisher: Royal Society of Chemistry

Published: 2012-09

Total Pages: 229

ISBN-13: 1849734127

DOWNLOAD EBOOK

Reflecting the growing volume of published work in this field, researchers will find this book an invaluable source of information on current chemical modelling methods and applications.


Proceedings of the International Conference of Computational Methods in Sciences and Engineering 2003 (ICCMSE 2003)

Proceedings of the International Conference of Computational Methods in Sciences and Engineering 2003 (ICCMSE 2003)

Author: T. E. Simos

Publisher: World Scientific

Published: 2003

Total Pages: 724

ISBN-13: 9789812704658

DOWNLOAD EBOOK

In the past few decades, many significant insights have been gained into several areas of computational methods in sciences and engineering. New problems and methodologies have appeared in some areas of sciences and engineering. There is always a need in these fields for the advancement of information exchange. The aim of this book is to facilitate the sharing of ideas, problems and methodologies between computational scientists and engineers in several disciplines. Extended abstracts of papers on the recent advances regarding computational methods in sciences and engineering are provided. The book briefly describes new methods in numerical analysis, computational mathematics, computational and theoretical physics, computational and theoretical chemistry, computational biology, computational mechanics, computational engineering, computational medicine, high performance computing, etc.


Advanced Structural Inorganic Chemistry

Advanced Structural Inorganic Chemistry

Author: Wai-Kee Li

Publisher: OUP Oxford

Published: 2008-03-27

Total Pages: 848

ISBN-13: 0191527149

DOWNLOAD EBOOK

This book is a revised and updated English edition of a textbook that has grown out of several years of teaching. The term "inorganic" is used in a broad sense as the book covers the structural chemistry of representative elements (including carbon) in the periodic table, organometallics, coordination polymers, host-guest systems and supramolecular assemblies. Part I of the book reviews the basic bonding theories, including a chapter on computational chemistry. Part II introduces point groups and space groups and their chemical applications. Part III comprises a succinct account of the structural chemistry of the elements in the periodic table. It presents structure and bonding, generalizations of structural trends, crystallographic data, as well as highlights from the recent literature.


Energetic Materials

Energetic Materials

Author: John R. Sabin

Publisher: Academic Press

Published: 2014-02-10

Total Pages: 357

ISBN-13: 0128004509

DOWNLOAD EBOOK

Advances 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. It features detailed reviews written by leading international researchers. This volume focuses on the theory of heavy ion physics in medicine. - This volume presents a series of articles concerning current important topics in quantum chemistry. The invited articles are written by the best people in the field


Atomic and Molecular Nonlinear Optics: Theory, Experiment and Computation

Atomic and Molecular Nonlinear Optics: Theory, Experiment and Computation

Author: G. Maroulis

Publisher: IOS Press

Published: 2011-05-27

Total Pages: 544

ISBN-13: 1607507420

DOWNLOAD EBOOK

The papers collected in this volume in honor of the late Stanisław Kielich cover an impressive range of modern subjects in molecular science. These subjects include, among others, the nonlinear optics of molecules, new approaches to the electronic structure of large molecules, the properties of carbon nanotubes, fluorescence polarization spectroscopy, computational studies of systems of fundamental interest to collision-induced spectroscopy, the simulation of fluids, NLO materials, chemical bonding in complex molecules, the NLO properties of functionalized DNA and the magnetic properties of molecular assemblies. Written by eminent specialists, the papers should offer valuable guidance to a wide community of graduate students and researchers.