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Computational Methods For Electron Molecule Collisions
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Book Synopsis Computational Methods for Electron—Molecule Collisions by : Franco A. Gianturco
Download or read book Computational Methods for Electron—Molecule Collisions written by Franco A. Gianturco and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 374 pages. Available in PDF, EPUB and Kindle. Book excerpt: The collision of electrons with molecules and molecular ions is a fundamental pro cess in atomic and molecular physics and in chemistry. At high incident electron en ergies, electron-molecule collisions are used to deduce molecular geometries, oscillator strengths for optically allowed transitions, and in the case of electron-impact ionization, to probe the momentum distribution of the molecule itself. When the incident electron energy is comparable to or below those of the molecular valence electrons, the physics involved is particularly rich. Correlation and exchange effects necessary to describe such collision processes bear a close resemblance to similar efft:cts in the theory of electronic structure in molecules. Compound state formations, in the form of resonances and vir tual states, manifest themselves in experimental observables which provide details of the electron-molecule interactions. Ro-vibrational excitations by low-energy electron collisions exemplify energy transfer between the electronic and nuclear motion. The role of nonadiabatic interaction is raised here. When the final vibrational state is in the continuum, molecular dissociation occurs. Dissociative recombination and dissociative attachment are examples of such fragmentation processes. In addition to its fundamental nature, the study of electron-molecule collisions is also motivated by its relation to other fields of study and by its technological appli cations. The study of planetary atmospheres and the interstellar medium necessarily involve collision processes of electrons with molecules and molecular ions.
Book Synopsis Electron-Atom and Electron-Molecule Collisions by : Jürgen Hinze
Download or read book Electron-Atom and Electron-Molecule Collisions written by Jürgen Hinze and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 353 pages. Available in PDF, EPUB and Kindle. Book excerpt: The papers collected in this volume have been presented during a workshop on "Electron-Atom and Molecule Collisions" held at the Centre for Interdisciplinary Studies of the University of Bielefeld in May 1980. This workshop, part of a larger program concerned with the "Properties and Reactions of Isolated Molecules and Atoms," focused on the theory and computational techniques for the quanti tative description of electron scattering phenomena. With the advances which have been made in the accurate quantum mechanical characterisation of bound states of atoms and molecules, the more complicated description of the unbound systems and resonances important in electron collision processes has matured too. As expli cated in detail in the articles of this volume, the theory for the quantitative explanation of elastic and inelastic electron molecule collisions, of photo- and multiple photon ionization and even for electron impact ionization is well developed in a form which lends itself to a complete quantitative ab initio interpretation and pre diction of the observable effects. Many of the experiences gained and the techniques which have evolved over the years in the com putational characterization of bound states have become an essential basis for this development. To be sure, much needs to be done before we have a complete and detailed theoretical understanding of the known collisional processes and of the phenomena and effects, which may still be un covered with the continuing refinement of the experimental tech niques.
Book Synopsis Electron-Molecule Collisions by : Isao Shimamura
Download or read book Electron-Molecule Collisions written by Isao Shimamura and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 578 pages. Available in PDF, EPUB and Kindle. Book excerpt: Scattering phenomena play an important role in modern physics. Many significant discoveries have been made through collision experiments. Amongst diverse kinds of collision systems, this book sheds light on the collision of an electron with a molecule. The electron-molecule collision provides a basic scattering problem. It is scattering by a nonspherical, multicentered composite particle with its centers having degrees of freedom of motion. The molecule can even disintegrate, Le., dissociate or ionize into fragments, some or all of which may also be molecules. Although it is a difficult problem, the recent theoretical, experimental, and computational progress has been so significant as to warrant publication of a book that specializes in this field. The progress owes partly to technical develop ments in measurements and computations. No less important has been the great and continuing stimulus from such fields of application as astrophysics, the physics of the earth's upper atmosphere, laser physics, radiation physics, the physics of gas discharges, magnetohydrodynamic power generation, and so on. This book aims at introducing the reader to the problem of electron molecule collisions, elucidating the physics behind the phenomena, and review ing, to some extent, up-to-date important results. This book should be appropri ate for graduate reading in physics and chemistry. We also believe that investi gators in atomic and molecular physics will benefit much from this book.
Book Synopsis Computational Atomic Physics by : Klaus Bartschat
Download or read book Computational Atomic Physics written by Klaus Bartschat and published by Springer. This book was released on 2013-06-29 with total page 264 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational Atomic Physics deals with computational methods for calculating electron (and positron) scattering from atoms and ions, including elastic scattering, excitation, and ionization processes. Each chapter is divided into abstract, theory, computer program with sample input and output, summary, suggested problems, and references. An MS-DOS diskette is included, which holds 11 programs covering the features of each chapter and therefore contributing to a deeper understanding of the field. Thus the book provides a unique practical application of advanced quantum mechanics.
Book Synopsis Electron-Molecule and Photon-Molecule Collisions by : T.N. Rescigno
Download or read book Electron-Molecule and Photon-Molecule Collisions written by T.N. Rescigno and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 350 pages. Available in PDF, EPUB and Kindle. Book excerpt: The First Asilomar Conference on Electron- and Photon-Molecule Collisions was held August 1-4, 1978 in Pacific Grove, California. This meeting brought together forty scientists who are actively involved in theoretical studies of electron scattering by, and photoionization of, small molecules. In this volume, are collected the contributions of the invited speakers, as well as the roundtable and evening discussions condensed from taped recordings of the entire proceedings. The subject matter reflects current activity in the field and describes many of the techniques that are being developed and applied to molecular collision problems. We would like to thank the Air Force Office of Scientific Research (AFOSR) and the Office of Naval Research (ONR) for providing the financial support that made this conference possible. Special thanks are due to Dr. Robert Junker of ONR and Dr. Ralph Kelley of AFOSR for the interest and encouragement they provided in all phases of this meeting. We also thank all the participants whose efforts and contributions made this conference a success. Finally, we thank Ms. Charlotte MacNaughton and Ms. Sara Jackson for the many hours they spent transcribing tapes and preparing this volume for publication.
Book Synopsis Novel Aspects of Electron-molecule Collisions by : Kurt H. Becker
Download or read book Novel Aspects of Electron-molecule Collisions written by Kurt H. Becker and published by World Scientific. This book was released on 1998 with total page 364 pages. Available in PDF, EPUB and Kindle. Book excerpt: Covers theoretical and experimental activities in the field of electron molecule collisions, with chapters on areas including positive and negative ion formation in electron collisions with fullerenes, spin effects in electron molecule collisions, collisions with oriented and aligned molecules, and electron impact dissociative excitation and ionization of molecular ions. Other subjects include electron-molecule cross sections for plasma application, and improvements to the complex Kohn variational method. No index. Annotation copyrighted by Book News, Inc., Portland, OR
Book Synopsis Swarm Studies and Inelastic Electron-Molecule Collisions by : Leanne C. Pitchford
Download or read book Swarm Studies and Inelastic Electron-Molecule Collisions written by Leanne C. Pitchford and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 402 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume presents the contributions of participants in the Symposium on Swarm Studies and Inelastic Electron-Molecule Collisions, held on July 19-23, 1985, in Tahoe City, California. This was a joint meeting of the Fourth International Swarm Seminar and the Electron-Molecule Collisions Symposium which have been traditionally separate satellite symposia to the International Conference on the Physics of Electronic and Atomic Collisions (ICPEAC). In the early stages of planning for these two satellite symposia to the XIVth ICPEAC, a group of us recognized the significant scientific merit and advantages of having a joint symposium. This idea was particularly appealing due to a large mutual interest in important advances (theoretical, experimental, and modeling) in both fields, and because it provides a forum to bring together a single-collision point of view with a multiple-collision one. For example, studies of multiple-term solutions to Boltzmann's equation and their application to swarm systems are intrinsically coupled to the availability of both integral and differential cross-sections for electron-molecule collisions. In tum, experimental and theoretical studies of these electron-molecule scattering cross-sections are becoming quite sophisticated, accurate, and comprehensive. Furthermore, in swarm studies, computational and experimental methods have advanced to the point where detailed and meaningful comparison with, and use of, single-collision beam data is now possible. More over, recent experimental advances in the study of single-collision electron at tachment phenomena have provided a significant overlap with swarm data and extension to subthermal energies.
Book Synopsis Atom - Molecule Collision Theory by : Richard Barry Bernstein
Download or read book Atom - Molecule Collision Theory written by Richard Barry Bernstein and published by Springer. This book was released on 2013-06-14 with total page 779 pages. Available in PDF, EPUB and Kindle. Book excerpt: The broad field of molecular collisions is one of considerable current interest, one in which there is a great deal of research activity, both experi mental and theoretical. This is probably because elastic, inelastic, and reactive intermolecular collisions are of central importance in many of the fundamental processes of chemistry and physics. One small area of this field, namely atom-molecule collisions, is now beginning to be "understood" from first principles. Although the more general subject of the collisions of polyatomic molecules is of great im portance and intrinsic interest, it is still too complex from the viewpoint of theoretical understanding. However, for atoms and simple molecules the essential theory is well developed, and computational methods are sufficiently advanced that calculations can now be favorably compared with experimental results. This "coming together" of the subject (and, incidentally, of physicists and chemists !), though still in an early stage, signals that the time is ripe for an appraisal and review of the theoretical basis of atom-molecule collisions. It is especially important for the experimentalist in the field to have a working knowledge of the theory and computational methods required to describe the experimentally observable behavior of the system. By now many of the alternative theoretical approaches and computational procedures have been tested and intercompared. More-or-Iess optimal methods for dealing with each aspect are emerging. In many cases working equations, even schematic algorithms, have been developed, with assumptions and caveats delineated.
Book Synopsis Computational Atomic Physics by : Klaus Bartschat
Download or read book Computational Atomic Physics written by Klaus Bartschat and published by Springer. This book was released on 2014-10-03 with total page 249 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational Atomic Physics deals with computational methods for calculating electron (and positron) scattering from atoms and ions, including elastic scattering, excitation, and ionization processes. Each chapter is divided into abstract, theory, computer program with sample input and output, summary, suggested problems, and references. An MS-DOS diskette is included, which holds 11 programs covering the features of each chapter and therefore contributing to a deeper understanding of the field. Thus the book provides a unique practical application of advanced quantum mechanics.
Book Synopsis Atom - Molecule Collision Theory by : Richard Barry Bernstein
Download or read book Atom - Molecule Collision Theory written by Richard Barry Bernstein and published by Springer. This book was released on 2013-04-16 with total page 779 pages. Available in PDF, EPUB and Kindle. Book excerpt: The broad field of molecular collisions is one of considerable current interest, one in which there is a great deal of research activity, both experi mental and theoretical. This is probably because elastic, inelastic, and reactive intermolecular collisions are of central importance in many of the fundamental processes of chemistry and physics. One small area of this field, namely atom-molecule collisions, is now beginning to be "understood" from first principles. Although the more general subject of the collisions of polyatomic molecules is of great im portance and intrinsic interest, it is still too complex from the viewpoint of theoretical understanding. However, for atoms and simple molecules the essential theory is well developed, and computational methods are sufficiently advanced that calculations can now be favorably compared with experimental results. This "coming together" of the subject (and, incidentally, of physicists and chemists !), though still in an early stage, signals that the time is ripe for an appraisal and review of the theoretical basis of atom-molecule collisions. It is especially important for the experimentalist in the field to have a working knowledge of the theory and computational methods required to describe the experimentally observable behavior of the system. By now many of the alternative theoretical approaches and computational procedures have been tested and intercompared. More-or-Iess optimal methods for dealing with each aspect are emerging. In many cases working equations, even schematic algorithms, have been developed, with assumptions and caveats delineated.
Book Synopsis Electron-Molecule Scattering and Photoionization by : P.G. Burke
Download or read book Electron-Molecule Scattering and Photoionization written by P.G. Burke and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 275 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains the invited papers and selected contributed papers presented at the International Symposium on 'Electron-Molecule Scattering and Photoionization' held at SERC's Daresbury Laboratory, Cheshire, England from 18th to 19th July, 1987. This Symposium was a Satellite Meeting to the XVth International Conference on the Physics of Electronic and Atomic Collisions (ICPEAC I and follows a tradition of Satellite Meetings i. n related areas of collisions held in association with previous ICPEAC's. In order to make this volume as representative of the Symposium as possible 'Hot Topics' presented orally at the meeting together with a few papers selected by the Programme Committee from the contributed posters are included. The Editors are grateful to the authors for responding rapidly to the invitation to submit their contri butions for inclusion in the volume, as indeed they are grateful to all the authors for the high quality of their contributions. The Symposium brought together over 100 scientists from many countries and from broad interdisciplinary backgrounds to hear about current rapid advances in electron-molecule scatteri. ng and photoioniza tion. These advances have been stimulated on the experimental side by the increasing availability of electron beams with millivolt energy resolution, by synchrotron radiation sources and by intense tunable lasers. On the theoretical side the introduction of new computational methods enables accurate predictions to be made, resulting in a new and deeper understanding of the basic physical processes involved.
Book Synopsis Electron Collisions with Molecules, Clusters, and Surfaces by : H. Ehrhardt
Download or read book Electron Collisions with Molecules, Clusters, and Surfaces written by H. Ehrhardt and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 265 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains the invited papers and selected contributed papers presented at the biennial International Symposium on ELECTRON COLLISIONS WITH MOLECULES, CLUSTERS AND SURF ACES held at Royal Holloway, University of London from 29th to 30th July, 1993. This Symposium was a Satellite Meeting of the XVIII International Conference on the Physics of Electronic and Atomic Collisions (ICPEAC) and follows a 16 year tradition of Satellite Conferences in related areas of collisions held in association with previous ICPEAC's. In the past each of these electron -molecule symposia covered the broad field of electron-molecule scattering at rather low energies, but also included hot topics. This time as well as covering the whole field, well defined electron collisions with clusters and with particles in the complex potential of a surface were emphasized. Not many details are known about such collisions, although they become more and more important in surface characterisation, plasma-wall interactions, electron induced desorption and reorganisation of adsorbed particles. Recently, much work, theoretical and experimental, has been devoted to electron collisions with rather large carbon, silicon and halogen containing molecules. These problems are of relevance in plasma assisted thin film formation and etching of surfaces and can now be approached with advanced theoretical methods and experimental equipment.
Book Synopsis Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces by : Petr Carsky
Download or read book Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces written by Petr Carsky and published by CRC Press. This book was released on 2016-04-19 with total page 296 pages. Available in PDF, EPUB and Kindle. Book excerpt: Since the turn of the 21st century, the field of electron molecule collisions has undergone a renaissance. The importance of such collisions in applications from radiation chemistry to astrochemistry has flowered, and their role in industrial processes such as plasma technology and lighting are vital to the advancement of next generation devices. Furthermore, the development of the scanning tunneling microscope highlights the role of such collisions in the condensed phase, in surface processing, and in the development of nanotechnology. Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces highlights recent progress in the theory and experiment of electron-molecule collisions, providing a detailed review of the current state of knowledge of electron molecule scattering—theoretical and experimental—for the general physicist and chemist interested in solving practical problems. In few other branches of science is the collaboration between theorists and experimentalists so topical. Covering advancements in practical problems, such as those met in plasma physics, microelectronics, nanolithography, DNA research, atmospheric chemistry, and astrochemistry, this book describes the formal general scattering theory and description of the experimental setup at a level the interested non-expert can appreciate.
Book Synopsis Molecular Physics and Hypersonic Flows by : M. Capitelli
Download or read book Molecular Physics and Hypersonic Flows written by M. Capitelli and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 798 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular Physics and Hypersonic Flows bridges the gap between the fluid dynamics and molecular physics communities, emphasizing the role played by elementary processes in hypersonic flows. In particular, the work is primarily dedicated to filling the gap between microscopic and macroscopic treatments of the source terms to be inserted in the fluid dynamics codes. The first part of the book describes the molecular dynamics of elementary processes both in the gas phase and in the interaction with surfaces by using quantum mechanical and phenomenological approaches. A second group of contributions describes thermodynamics and transport properties of air components, with special attention to the transport of internal energy. A series of papers is devoted to the experimental and theoretical study of the flow of partially ionized gases. Subsequent contributions treat modern computational techniques for 3-D hypersonic flow. Non-equilibrium vibrational kinetics are then described, together with the coupling of vibration-dissociation processes as they affect hypersonic flows. Special emphasis is given to the interfacing of non-equilibrium models with computational fluid dynamics methods. Finally, the last part of the book deals with the application of direct Monte Carlo methods in describing rarefied flows.
Book Synopsis Low-Energy Electrons by : Oddur Ingólfsson
Download or read book Low-Energy Electrons written by Oddur Ingólfsson and published by CRC Press. This book was released on 2019-04-23 with total page 274 pages. Available in PDF, EPUB and Kindle. Book excerpt: Low-energy electrons are ubiquitous in nature and play an important role in natural phenomena as well as many potential and current industrial processes. Authored by 16 active researchers, this book describes the fundamental characteristics of low-energy electron–molecule interactions and their role in different fields of science and technology, including plasma processing, nanotechnology, and health care, as well as astro- and atmospheric physics and chemistry. The book is packed with illustrative examples, from both fundamental and application sides, features about 130 figures, and lists over 800 references. It may serve as an advanced graduate-level study course material where selected chapters can be used either individually or in combination as a basis to highlight and study specific aspects of low-energy electron–molecule interactions. It is also directed at researchers in the fields of plasma physics, nanotechnology, and radiation damage to biologically relevant material (such as in cancer therapy), especially those with an interest in high-energy-radiation-induced processes, from both an experimental and a theoretical point of view.
Book Synopsis Electron Collision Processes in Atomic and Molecular Physics by : P. C. Minaxi Vinodkumar
Download or read book Electron Collision Processes in Atomic and Molecular Physics written by P. C. Minaxi Vinodkumar and published by . This book was released on 2014 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: Contains expertise articles on emerging research areas in the field of atomic and molecular interactions with charge particles in general. The different topics presented include a wide range from ab-initio methods to complex quantum mechanical calculations apart from experimental measurements of various collision cross sections. The power of modern computational techniques and the latest experimental status and facilities covered in this book will be very useful for all those who are interested to choose a research career in atomic and molecular physics. The cross section data for wide energy range presented in this volume covers simple molecules to very complex molecules of biological relevance. It is important to note that such collision data will find applications in environmental science, semiconductor physics, plasma physics, astro-chemistry, radio-biology etc. The articles are authored by leading researchers and I am sure that this volume will provide information, inspiration and new directions both to the experts and beginners alike.
Book Synopsis Electron Correlation in Molecules – ab initio Beyond Gaussian Quantum Chemistry by :
Download or read book Electron Correlation in Molecules – ab initio Beyond Gaussian Quantum Chemistry written by and published by Academic Press. This book was released on 2016-01-28 with total page 440 pages. Available in PDF, EPUB and Kindle. Book excerpt: Electron Correlation in Molecules – ab initio Beyond Gaussian Quantum Chemistry 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 The volume includes review on all the topics treated by world renown authors and cutting edge research contributions.
