Relativistic Effects In Atoms Molecules And Solids

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Relativistic Effects in Atoms, Molecules, and Solids

Author : G.L. Malli
Publisher : Springer Science & Business Media
ISBN 13 : 1461335965
Total Pages : 539 pages
Book Rating : 4.4/5 (613 download)

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Book Synopsis Relativistic Effects in Atoms, Molecules, and Solids by : G.L. Malli

Download or read book Relativistic Effects in Atoms, Molecules, and Solids written by G.L. Malli and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 539 pages. Available in PDF, EPUB and Kindle. Book excerpt: The NATO Advanced Study Institute (ASI) on "Relativistic Effects in Atoms, Molecules and Solids" cosponsored by Simon Fraser University (SFU) and Natural Sciences and Engineering Research Council of Canada (NSERC) was held at the University of British Columbia (UBC) , Van couver, Canada from August 10th until August 21st, 1981. A total of 77 lecturers and students with diverse backgrounds in Chemistry, Physics, Mathematics and various interdisciplinary subjects attended the ASI. In the proposal submitted to NATO for financial support for this ASI, it was suggested that recent impressive experimental developments coupled with the availability of sophisticated computer technology for detailed investigation of the relativistic structure of atoms, molecules and solids would provide an excellent testing ground for the validity and accuracy of the theoretical treatment of the rela tivistic many-electron systems involving medium and heavy atoms. Such systems are also of interest to the current energy crisis because of their usage for photovoltaic devices, nuclear fuels (UF6), fusion lasers (Xe*2)' catalysts for solar energy conversion, etc.

The Effects of Relativity in Atoms, Molecules, and the Solid State

Author : Stephen Wilson
Publisher : Springer Science & Business Media
ISBN 13 : 1461537029
Total Pages : 341 pages
Book Rating : 4.4/5 (615 download)

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Book Synopsis The Effects of Relativity in Atoms, Molecules, and the Solid State by : Stephen Wilson

Download or read book The Effects of Relativity in Atoms, Molecules, and the Solid State written by Stephen Wilson and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 341 pages. Available in PDF, EPUB and Kindle. Book excerpt: Recent years have seen a growing interest in the effects of relativity in atoms, molecules and solids. On the one hand, this can be seen as result of the growing awareness of the importance of relativity in describing the properties of heavy atoms and systems containing them. This has been fueled by the inadequacy of physical models which either neglect relativity or which treat it as a small perturbation. On the other hand, it is dependent upon the technological developments which have resulted in computers powerful enough to make calculations on heavy atoms and on systems containing heavy atoms meaningful. Vector processing and, more recently, parallel processing techniques are playing an increasingly vital role in rendering the algorithms which arise in relativistic studies tractable. This has been exemplified in atomic structure theory, where the dominant role of the central nuclear charge simplifies the problem enough to permit some prediction to be made with high precision, especially for the highly ionized atoms of importance in plasma physics and in laser confinement studies. Today's sophisticated physical models of the atom derived from quantum electrodynamics would be intractable without recourse to modern computational machinery. Relativistic atomic structure calculations have a history dating from the early attempts of Swirles in the mid 1930's but continue to provide one of the primary test beds of modern theoretical physics.

Relativistic Effects in Atoms, Molecules, and Solids

Author : G L Malli
Publisher :
ISBN 13 : 9781461335979
Total Pages : 556 pages
Book Rating : 4.3/5 (359 download)

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Book Synopsis Relativistic Effects in Atoms, Molecules, and Solids by : G L Malli

Download or read book Relativistic Effects in Atoms, Molecules, and Solids written by G L Malli and published by . This book was released on 1983-04-01 with total page 556 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Relativistic and Electron Correlation Effects in Molecules and Solids

Author : G.L. Malli
Publisher : Springer Science & Business Media
ISBN 13 : 1489913408
Total Pages : 478 pages
Book Rating : 4.4/5 (899 download)

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Book Synopsis Relativistic and Electron Correlation Effects in Molecules and Solids by : G.L. Malli

Download or read book Relativistic and Electron Correlation Effects in Molecules and Solids written by G.L. Malli and published by Springer Science & Business Media. This book was released on 2013-11-21 with total page 478 pages. Available in PDF, EPUB and Kindle. Book excerpt: The NATO Advanced Study Institute (ASI) on "R@lativistic and Electron Correlation Effects in Molecules and Solids", co-sponsored by Simon Fraser University (SFU) and the Natural Sciences and Engineering Research Council of Canada (NSERC) was held Aug 10- 21, 1992 at the University of British Columbia (UBC), Vancouver, Canada. A total of 90 lecturers and students with backgrounds in Chemistry, Physics, Mathematics and various interdisciplinary subjects attended the ASI. In my proposal submitted to NATO for financial support for this ASI, I pointed out that a NATO ASI on the effects of relativity in many-electron systems was held ten years ago, [See G.L. Malli, (ed) Relativistic Effects in Atoms, Molecules and Solids, Plenum Press, Vol B87, New York, 1983]. Moreover, at a NATO Advanced Research Workshop (ARW) on advanced methods for molecular electronic structure "an assessment of state-of the-art of Electron Correlation ... " was carried out [see C.E. Dykstra, (ed), Advanced Theories and Computational Approaches to the Electronic Structure of Molecules, D. Reidel Publishin~ Company, Vol C133, Dordrecht, The Netherlands 1984]. However, during the last five years, it has become clear that the relativistic and electron correlation effects must be included in the theoretical treatment of many-electron molecules and solids of heavy elements (with Z > 70). Molecules and clusters containing heavy elements are of crucial importance in a number of areas of Chemistry and Physics such as nuclear fuels, catalysis, surface science, etc.

Relativistic Quantum Theory of Atoms and Molecules

Author : Ian P Grant
Publisher : Springer Science & Business Media
ISBN 13 : 0387350691
Total Pages : 813 pages
Book Rating : 4.3/5 (873 download)

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Book Synopsis Relativistic Quantum Theory of Atoms and Molecules by : Ian P Grant

Download or read book Relativistic Quantum Theory of Atoms and Molecules written by Ian P Grant and published by Springer Science & Business Media. This book was released on 2007-04-15 with total page 813 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is intended for physicists and chemists who need to understand the theory of atomic and molecular structure and processes, and who wish to apply the theory to practical problems. As far as practicable, the book provides a self-contained account of the theory of relativistic atomic and molecular structure, based on the accepted formalism of bound-state Quantum Electrodynamics. The author was elected a Fellow of the Royal Society of London in 1992.

A Relativistic Treatment of Atoms and Molecules

Author : Christian Thierfelder
Publisher : Sudwestdeutscher Verlag Fur Hochschulschriften AG
ISBN 13 : 9783838122137
Total Pages : 0 pages
Book Rating : 4.1/5 (221 download)

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Book Synopsis A Relativistic Treatment of Atoms and Molecules by : Christian Thierfelder

Download or read book A Relativistic Treatment of Atoms and Molecules written by Christian Thierfelder and published by Sudwestdeutscher Verlag Fur Hochschulschriften AG. This book was released on 2010-11 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: Relativistic quantum chemistry is the relativistic formulation of quantum mechanics applied to many-electron systems, that is to atoms, molecules and solids. It combines the principles of special relativity, which are obeyed by any fundamental physical theory, with the basic rules of quantum mechanics. By construction, it represents the most fundamental theory of all molecular sciences, which describes matter by the action, interaction and motion of the elementary particles. This science is of vital importance to physicists, chemists, material scientists, and biologists with a molecular view of the world. A full relativistic treatment of atoms and molecules which includes the quantization of the electromagnetic field is currently one of the most challenging tasks in electronic structure theory. Therefore, relativistic effects in atoms and molecules were studied computationally. A combination of wave function and density functional based methods within a correct relativistic framework proved necessary to achieve accurate results of various atomic and molecular properties.

Relativistic Theory of Atoms and Molecules III

Author : Pekka Pyykkö
Publisher : Springer Science & Business Media
ISBN 13 : 3642518850
Total Pages : 362 pages
Book Rating : 4.6/5 (425 download)

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Book Synopsis Relativistic Theory of Atoms and Molecules III by : Pekka Pyykkö

Download or read book Relativistic Theory of Atoms and Molecules III written by Pekka Pyykkö and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 362 pages. Available in PDF, EPUB and Kindle. Book excerpt: Relativistic effects are of major importance for understanding the properties of heavier atoms and molecules. Volumes I-III of Relativistic Theory of Atoms and Molecules constitute the only available bibliography on related calculations. In Volume III, 3792 new references covering 1993-1999 are added to the database. The material is characterized by an analysis of the respective papers. The volume gives the user a comprehensive bibliography on relativistic atomic and molecular calculations, including studies on the Dirac equation and related solid-state work.

Relativistic Theory of Atoms and Molecules II

Author : Pekka Pyykkö
Publisher : Springer Science & Business Media
ISBN 13 : 364251488X
Total Pages : 486 pages
Book Rating : 4.6/5 (425 download)

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Book Synopsis Relativistic Theory of Atoms and Molecules II by : Pekka Pyykkö

Download or read book Relativistic Theory of Atoms and Molecules II written by Pekka Pyykkö and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 486 pages. Available in PDF, EPUB and Kindle. Book excerpt: Relativistic effects are of major importance for understan- ding the properties of heavier atoms and molecules. This book is still the only comprehensive bibliography on related calculations. The material is organized by subject into ta- bles containing a concise characterization. Together with Volume I (Lecture Notes in Chemistry Vol. 41, ISBN 3-540-17167-3) the literature until 1992 is now covered and 6577 references, with titles, are given in the two books. The book will provide aconvenient reference for theoretical chemists and atomic and molecular physicists interested in the properties of heavier elements. Contents: Introduction - One-particle problems - Quantum electrodynamical effects - Multielectron atoms: methods - Multielectron atoms: results - Symmetry - Molecular calcula- tions - Solid-state theory - Relativistic effects and heavy- element chemistry - Corrections to Volume I - Some comments on notations and terminology - List of acronyms and symbols - Bibliography.

Relativistic Theory of Atoms and Molecules

Author : Pekka Pyykkö
Publisher : Springer Science & Business Media
ISBN 13 : 3642933459
Total Pages : 394 pages
Book Rating : 4.6/5 (429 download)

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Book Synopsis Relativistic Theory of Atoms and Molecules by : Pekka Pyykkö

Download or read book Relativistic Theory of Atoms and Molecules written by Pekka Pyykkö and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 394 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Excited States in Quantum Chemistry

Author : Cleanthes A. Nicolaides
Publisher : Springer Science & Business Media
ISBN 13 : 940099902X
Total Pages : 572 pages
Book Rating : 4.4/5 (9 download)

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Book Synopsis Excited States in Quantum Chemistry by : Cleanthes A. Nicolaides

Download or read book Excited States in Quantum Chemistry written by Cleanthes A. Nicolaides and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 572 pages. Available in PDF, EPUB and Kindle. Book excerpt: It is undoubtedly true that much of the progress in the quant~m theory of matter is due to the remarkable success of the independent particle model (IPM)--especially in describing ground states. However, the accurate experimental results of the last 10 years or so, on a variety of spectroscopic phenomena and chemical processes which involve the Excited State, and the related failure of the IPM to reproduce accurately--in many cases, even qualitatively--the observed data, have sent to theorists a clear message: There is need to create and/or apply general and useful approaches to the many-electron problem of the excited state which go beyond the IPM, treat electron correlation and relativity and explain or predict all relevant physical or chemical information with consistent accuracy. This book contains articles devoted mainly to some of the most important new developments in Quantum Chemistry concerning the theoretical foundations and the computational implementation of many-body approaches to the quantitative and detailed under standing of the electronic excited states of atoms, molecules and solids. Furthermore, it contains experimental and pheno menological articles on Photoelectron and Auger spectroscopy, Lifetime measurements and Organic Photochemistry. In combination or individually, these articles constitute a good description of some current theoretical and experimental work on the electronic structure and spectroscopy of atoms, molecules, polymers, surfaces, metal oxides and amorphous solids.

Relativistic and Electron Correlation Effects in Molecules and Solids

Author : Gulzari Malli
Publisher :
ISBN 13 : 9781489913418
Total Pages : 488 pages
Book Rating : 4.9/5 (134 download)

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Book Synopsis Relativistic and Electron Correlation Effects in Molecules and Solids by : Gulzari Malli

Download or read book Relativistic and Electron Correlation Effects in Molecules and Solids written by Gulzari Malli and published by . This book was released on 2014-09-01 with total page 488 pages. Available in PDF, EPUB and Kindle. Book excerpt:

University Physics

Author : OpenStax
Publisher :
ISBN 13 : 9781680920451
Total Pages : 622 pages
Book Rating : 4.9/5 (24 download)

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Book Synopsis University Physics by : OpenStax

Download or read book University Physics written by OpenStax and published by . This book was released on 2016-11-04 with total page 622 pages. Available in PDF, EPUB and Kindle. Book excerpt: University Physics is a three-volume collection that meets the scope and sequence requirements for two- and three-semester calculus-based physics courses. Volume 1 covers mechanics, sound, oscillations, and waves. Volume 2 covers thermodynamics, electricity and magnetism, and Volume 3 covers optics and modern physics. This textbook emphasizes connections between between theory and application, making physics concepts interesting and accessible to students while maintaining the mathematical rigor inherent in the subject. Frequent, strong examples focus on how to approach a problem, how to work with the equations, and how to check and generalize the result. The text and images in this textbook are grayscale.

Electron Correlations in Molecules and Solids

Author : Peter Fulde
Publisher : Springer Science & Business Media
ISBN 13 : 3642578098
Total Pages : 492 pages
Book Rating : 4.6/5 (425 download)

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Book Synopsis Electron Correlations in Molecules and Solids by : Peter Fulde

Download or read book Electron Correlations in Molecules and Solids written by Peter Fulde and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 492 pages. Available in PDF, EPUB and Kindle. Book excerpt: Dieser Titel verbindet die Festkörpertheorie mit der Quantenchemie. Neue Konzepte der Vielteilchen-Verarbeitung und Korrelations-Effekte, normale quantenchemische Verfahren mit Projektionstechniken, Greensche Funktionen und Monte-Carlo-Methoden werden erarbeitet. Anwendungsbereiche der Molekültheorie, von Halbleitern, supraleitender high-Tc-Materialien, etc., werden vorgestellt.

Atoms, Solids, and Plasmas in Super-Intense Laser Fields

Author : Dimitri Batani
Publisher : Springer Science & Business Media
ISBN 13 : 9780306466151
Total Pages : 434 pages
Book Rating : 4.4/5 (661 download)

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Book Synopsis Atoms, Solids, and Plasmas in Super-Intense Laser Fields by : Dimitri Batani

Download or read book Atoms, Solids, and Plasmas in Super-Intense Laser Fields written by Dimitri Batani and published by Springer Science & Business Media. This book was released on 2001-09-30 with total page 434 pages. Available in PDF, EPUB and Kindle. Book excerpt: Proceedings of the 30th Course of the International School of Quantum Electronics on Atoms, Solids and Plasmas in Super-Intense Laser Fields, held 8-14 July, in Erice, Sicily

Atoms, Molecules and Photons

Author : Wolfgang Demtröder
Publisher : Springer
ISBN 13 : 3662555239
Total Pages : 551 pages
Book Rating : 4.6/5 (625 download)

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Book Synopsis Atoms, Molecules and Photons by : Wolfgang Demtröder

Download or read book Atoms, Molecules and Photons written by Wolfgang Demtröder and published by Springer. This book was released on 2019-02-09 with total page 551 pages. Available in PDF, EPUB and Kindle. Book excerpt: This introduction to Atomic and Molecular Physics explains how our present model of atoms and molecules has been developed over the last two centuries both by many experimental discoveries and, from the theoretical side, by the introduction of quantum physics to the adequate description of micro-particles. It illustrates the wave model of particles by many examples and shows the limits of classical description. The interaction of electromagnetic radiation with atoms and molecules and its potential for spectroscopy is outlined in more detail and in particular lasers as modern spectroscopic tools are discussed more thoroughly. Many examples and problems with solutions are offered to encourage readers to actively engage in applying and adapting the fundamental physics presented in this textbook to specific situations. Completely revised third edition with new sections covering all actual developments, like photonics, ultrashort lasers, ultraprecise frequency combs, free electron lasers, cooling and trapping of atoms, quantum optics and quantum information.

Relativistic Electronic Structure Theory - Fundamentals

Author :
Publisher : Elsevier
ISBN 13 : 0080540465
Total Pages : 947 pages
Book Rating : 4.0/5 (85 download)

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Book Synopsis Relativistic Electronic Structure Theory - Fundamentals by :

Download or read book Relativistic Electronic Structure Theory - Fundamentals written by and published by Elsevier. This book was released on 2002-11-22 with total page 947 pages. Available in PDF, EPUB and Kindle. Book excerpt: The first volume of this two part series is concerned with the fundamental aspects of relativistic quantum theory, outlining the enormous progress made in the last twenty years in this field. The aim was to create a book such that researchers who become interested in this exciting new field find it useful as a textbook, and do not have to rely on a rather large number of specialized papers published in this area. · No title is currently available that deals with new developments in relativistic quantum electronic structure theory · Interesting and relevant to graduate students in chemistry and physics as well as to all researchers in the field of quantum chemistry · As treatment of heavy elements becomes more important, there will be a constant demand for this title

Introduction to Relativistic Quantum Chemistry

Author : Kenneth G. Dyall
Publisher : Oxford University Press
ISBN 13 : 0190286377
Total Pages : 544 pages
Book Rating : 4.1/5 (92 download)

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Book Synopsis Introduction to Relativistic Quantum Chemistry by : Kenneth G. Dyall

Download or read book Introduction to Relativistic Quantum Chemistry written by Kenneth G. Dyall and published by Oxford University Press. This book was released on 2007-04-19 with total page 544 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book provides an introduction to the essentials of relativistic effects in quantum chemistry, and a reference work that collects all the major developments in this field. It is designed for the graduate student and the computational chemist with a good background in nonrelativistic theory. In addition to explaining the necessary theory in detail, at a level that the non-expert and the student should readily be able to follow, the book discusses the implementation of the theory and practicalities of its use in calculations. After a brief introduction to classical relativity and electromagnetism, the Dirac equation is presented, and its symmetry, atomic solutions, and interpretation are explored. Four-component molecular methods are then developed: self-consistent field theory and the use of basis sets, double-group and time-reversal symmetry, correlation methods, molecular properties, and an overview of relativistic density functional theory. The emphases in this section are on the basics of relativistic theory and how relativistic theory differs from nonrelativistic theory. Approximate methods are treated next, starting with spin separation in the Dirac equation, and proceeding to the Foldy-Wouthuysen, Douglas-Kroll, and related transformations, Breit-Pauli and direct perturbation theory, regular approximations, matrix approximations, and pseudopotential and model potential methods. For each of these approximations, one-electron operators and many-electron methods are developed, spin-free and spin-orbit operators are presented, and the calculation of electric and magnetic properties is discussed. The treatment of spin-orbit effects with correlation rounds off the presentation of approximate methods. The book concludes with a discussion of the qualitative changes in the picture of structure and bonding that arise from the inclusion of relativity.