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Computational Aspects Of Electric Polarizability Calculations
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Book Synopsis Computational Aspects of Electric Polarizability Calculations by : George Maroulis
Download or read book Computational Aspects of Electric Polarizability Calculations written by George Maroulis and published by IOS Press. This book was released on 2006 with total page 542 pages. Available in PDF, EPUB and Kindle. Book excerpt: Covers such subjects as: Ab initio and Density functional theory calculations of electric polarizability and hyperpolarizability, intermolecular forces, aromaticity, electric properties of solvated molecules, NLO materials, Raman intensities, polarizability of metal and semiconductor clusters, relativistic effects on electric properties, and more.
Book Synopsis Atoms, Molecules and Clusters in Electric Fields by : George Maroulis
Download or read book Atoms, Molecules and Clusters in Electric Fields written by George Maroulis and published by Imperial College Press. This book was released on 2006 with total page 694 pages. Available in PDF, EPUB and Kindle. Book excerpt: With the central importance of electric polarizability and hyperpolarizability for a wide spectrum of activities, this book charts the trends in the accurate theoretical determination of these properties in specialized fields. The contributions include reviews and original papers that extend from methodology to applications in specific areas of primary importance such as cluster science and organic synthesis of molecules with specific properties.
Book Synopsis Atomic and Molecular Nonlinear Optics: Theory, Experiment and Computation by : G. Maroulis
Download or read book Atomic and Molecular Nonlinear Optics: Theory, Experiment and Computation written by G. Maroulis and published by IOS Press. This book was released on 2011-05-27 with total page 544 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Book Synopsis Trends and Perspectives in Modern Computational Science by : George Maroulis
Download or read book Trends and Perspectives in Modern Computational Science written by George Maroulis and published by CRC Press. This book was released on 2006-10-27 with total page 605 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains a collection of the lectures of the invited speakers and symposium organizers presented at the International Conference of Computational methods in Science and Engineering (ICCMSE 2006), held in Chania, Greece, October 2006. The content of the papers bears upon new developments of Computational Science pertinent to Physics, Chemistry, Biology, Medicine, Mathematics and Engineering. Molecular Science is a privileged ground for the application and evaluation of new mathematical tools and computational methods. In recent years, novelty and progress with greatest conceivable speed is common experience. This flavor of research findings carrying many consequences for distant fields is easily evidenced in the lectures collected in this volume.
Book Synopsis Atoms, Molecules And Clusters In Electric Fields: Theoretical Approaches To The Calculation Of Electric Polarizability by : George Maroulis
Download or read book Atoms, Molecules And Clusters In Electric Fields: Theoretical Approaches To The Calculation Of Electric Polarizability written by George Maroulis and published by World Scientific. This book was released on 2006-07-31 with total page 693 pages. Available in PDF, EPUB and Kindle. Book excerpt: With the central importance of electric polarizability and hyperpolarizability for a wide spectrum of activities, this book charts the trends in the accurate theoretical determination of these properties in specialized fields. The contributions include reviews and original papers that extend from methodology to applications in specific areas of primary importance such as cluster science and organic synthesis of molecules with specific properties./a
Book Synopsis Interaction-induced Electric Properties of van der Waals Complexes by : Victor N. Cherepanov
Download or read book Interaction-induced Electric Properties of van der Waals Complexes written by Victor N. Cherepanov and published by Springer. This book was released on 2016-11-16 with total page 112 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Book Synopsis Computational Methods in Sciences and Engineering 2003 by : T E Simos
Download or read book Computational Methods in Sciences and Engineering 2003 written by T E Simos and published by World Scientific. This book was released on 2003-08-26 with total page 716 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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. Contents:Components for Time Series Receiver Clock Offset in GPS Solutions (P Abad)Some Numerical Methods for Stiff Problems (J C Butcher)Bifurcation Phenomena in Molecular Vibrational Spectroscopy (S C Farantos)Simulations of Spart in Random Fields (D T Hristopoulos)Electric Properties of Substituted Diacetylenes (P Karamanis & G Maroulis)Data Mining and Cryptology (E C Laskari et al.)A Finite Element Approach for the Dirac Radial Equation (L A A Nikolopoulos)Constraint Based Web Mining (I Petrounias et al.)Axisymmetric Rigid Bodies in Creeping Flow (J Roumeliotis)The Impact of Graphics Calculator on Mathematics Education in Asia (C-Y Suen)On the Systematic Construction of Molecular Basis Sets (S Wilson)and other papers Readership: Researchers and graduate students in any discipline involving scientific computation. Keywords:Numerical Analysis;Computational Mathematics;Computational and Theoretical Physics;Computational Chemistry;Computational Biology;Computational Mechanics;Computational Engineering, Computational Medicine;High Performance Computing
Book Synopsis Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - by :
Download or read book Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - written by and published by Academic Press. This book was released on 2016-01-14 with total page 248 pages. Available in PDF, EPUB and Kindle. Book excerpt: Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - Part B, presents a series of articles concerning important topics in quantum chemistry, including 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. 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
Download or read book Gold Chemistry written by Fabian Mohr and published by John Wiley & Sons. This book was released on 2009-04-20 with total page 425 pages. Available in PDF, EPUB and Kindle. Book excerpt: Written by world-class authors, this most recent major book on the topic highlights new and current trends as well as future directions. It is comprehensive in its scope, covering all aspects of gold chemistry -- from homogeneous to heterogeneous catalysis, from supramolecular assemblies to sensors and medicinal applications. The result is an invaluable work for both organic and inorganic chemists working in universities and industry, as well as material scientists.
Book Synopsis Analysis of Hydrogen Bonds in Crystals by : Sławomir J. Grabowski
Download or read book Analysis of Hydrogen Bonds in Crystals written by Sławomir J. Grabowski and published by MDPI. This book was released on 2018-09-27 with total page 323 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is a printed edition of the Special Issue "Analysis of Hydrogen Bonds in Crystals" that was published in Crystals
Book Synopsis Handbook of Nanophysics by : Klaus D. Sattler
Download or read book Handbook of Nanophysics written by Klaus D. Sattler and published by CRC Press. This book was released on 2010-09-17 with total page 912 pages. Available in PDF, EPUB and Kindle. Book excerpt: The field of nanoscience was pioneered in the 1980s with the groundbreaking research on clusters, which later led to the discovery of fullerenes. Handbook of Nanophysics: Clusters and Fullerenes focuses on the fundamental physics of these nanoscale materials and structures. Each peer-reviewed chapter contains a broad-based introduction and enhances
Book Synopsis Remington Education: Physical Pharmacy by : Blaine Templar Smith
Download or read book Remington Education: Physical Pharmacy written by Blaine Templar Smith and published by Pharmaceutical Press. This book was released on 2015-10-27 with total page 193 pages. Available in PDF, EPUB and Kindle. Book excerpt: Remington Education: Physical Pharmacy provides a simple, concise view of the concepts and applications of physical pharmacy.
Book Synopsis Electric-dipole Polarizabilities of Atoms, Molecules, and Clusters by : Keith D. Bonin
Download or read book Electric-dipole Polarizabilities of Atoms, Molecules, and Clusters written by Keith D. Bonin and published by World Scientific. This book was released on 1997 with total page 274 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is an in-depth review of experiment and theory on electric-dipole polarizabilities. It is broad in scope, encompassing atomic, molecular, and cluster polarizabilities. Both static and dynamic polarizabilities are treated (in the absence of absorption) and a full tensor picture of the polarizability is used. Traditional experimental techniques for measuring electric polarizabilities are described in detail. Recently developed experimental methods, including light forces, position-sensitive time-of-flight deflection, and atom interferometry, are also extensively discussed. Theoretical techniques for calculating polarizabilities are reviewed, including a discussion on the use of Gaussian basis sets. Many important comparisons between theory and experiment are summarized in an extensive set of tables of polarizabilities of important atoms, molecules, and clusters. Applications of polarizabilities to many areas of chemistry and physics are described, including optics, chemical structure, interactions of gases and particles with surfaces, and the interaction of molecules with light. The emphasis is on a lucid presentation of the ideas and results with up-to-date discussions on important applications such as optical tweezers and nanostructure fabrication. This book provides an excellent overview of the importance of polarizabilities in understanding the physical, electronic, and optical properties of particles in a regime that goes from free atoms to condensed-phase clusters.
Book Synopsis In the Frontiers of Computational Science by : George Maroulis
Download or read book In the Frontiers of Computational Science written by George Maroulis and published by CRC Press. This book was released on 2005-10-28 with total page 422 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains a collection of the lectures of the invited speakers and symposium organizers presented at the International Conference of Computational methods in Science and Engineering (ICCMSE 2005), held in Corinth, Greece, October 2005. The content of the papers bears upon new developments of Computational Science pertinent to Physics, Chemistry, Biology, Medicine, Mathematics and Engineering. Molecular Science is a privileged ground for the application and evaluation of new mathematical tools and computational methods. In recent years, novelty and progress with greatest conceivable speed is common experience. This flavor of research findings carrying many consequences for distant fields is easily evidenced in the lectures collected in this volume.
Book Synopsis Computational Methods in Science and Engineering by : George Maroulis
Download or read book Computational Methods in Science and Engineering written by George Maroulis and published by American Inst. of Physics. This book was released on 2007-12-14 with total page 704 pages. Available in PDF, EPUB and Kindle. Book excerpt: All papers have been peer-reviewed. The aim of ICCMSE 2007 is to bring together computational scientists and engineers from several disciplines in order to share methods, methodologies and ideas. The potential readers of these proceedings are all the scientists with interest in the following fields: Computational Mathematics, Theoretical Physics, Computational Physics, Theoretical Chemistry, Computational Chemistry, Mathematical Chemistry, Computational Engineering, Computational Mechanics, Computational Biology and Medicine, Scientific Computation, High Performance Computing, Parallel and Distributed Computing, Visualization, Problem Solving Environments, Software Tools, Advanced Numerical Algorithms, Modeling and Simulation of Complex Systems, Web-based Simulation and Computing, Grid-based Simulation and Computing, Computational Grids, and Computer Science.
Book Synopsis Organic Materials for Non-linear Optics II by : R. A. Hann
Download or read book Organic Materials for Non-linear Optics II written by R. A. Hann and published by . This book was released on 1991 with total page 416 pages. Available in PDF, EPUB and Kindle. Book excerpt: The proceedings of a symposium on recent developments in the field of non-linear optics, which included contributions from academia, industry and government research projects. The main topics discussed included small organic molecules, metal-organic compounds, polymers and devices.
Book Synopsis Computational Chemistry by : Errol G. Lewars
Download or read book Computational Chemistry written by Errol G. Lewars and published by Springer Science & Business Media. This book was released on 2007-05-08 with total page 471 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational chemistry has become extremely important in the last decade, being widely used in academic and industrial research. Yet there have been few books designed to teach the subject to nonspecialists. Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics is an invaluable tool for teaching and researchers alike. The book provides an overview of the field, explains the basic underlying theory at a meaningful level that is not beyond beginners, and it gives numerous comparisons of different methods with one another and with experiment. The following concepts are illustrated and their possibilities and limitations are given: - potential energy surfaces; - simple and extended Hückel methods; - ab initio, AM1 and related semiempirical methods; - density functional theory (DFT). Topics are placed in a historical context, adding interest to them and removing much of their apparently arbitrary aspect. The large number of references, to all significant topics mentioned, should make this book useful not only to undergraduates but also to graduate students and academic and industrial researchers.
