Internal Rotation In Molecules

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Internal Rotation In Molecules
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Author : Mavis Redshaw
language : en
Publisher: John Wiley & Sons
Release Date : 1974
Internal Rotation In Molecules written by Mavis Redshaw and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 1974 with Science categories.
Rotational Spectra And Molecular Structure
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Author : James E. Wollrab
language : en
Publisher: Academic Press
Release Date : 2013-10-22
Rotational Spectra And Molecular Structure written by James E. Wollrab and has been published by Academic Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-10-22 with Science categories.
Physical Chemistry, A Series of Monographs: Rotational Spectra and Molecular Structure covers the energy levels and rotational transitions. This book is divided into nine chapters that evaluate the rigid asymmetric top molecules and the nuclear spin statistics for asymmetric tops. Some of the topics covered in the book are the asymmetric rotor functions; rotational transition intensities; classes of molecules; nuclear spin statistics for linear molecules and symmetric tops; and classical appearance of centrifugal and coriolis forces. Other chapters deal with the energy levels and effects of centrifugal distortion, as well as the internuclear distance and moments of inertia. The discussion then shifts to the coriolis coupling effects on rotational constants and the perturbation treatment of vibration-rotational Hamiltonian. The last chapter is devoted to the examination of origin of the quadrupole interaction. The book can provide useful information to chemists, physicists, electrical engineers, students, and researchers.
Structure Of Molecules And Internal Rotation
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Author : Sanʼichirō Mizushima
language : en
Publisher:
Release Date : 1954
Structure Of Molecules And Internal Rotation written by Sanʼichirō Mizushima and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1954 with Molecular rotation categories.
Microwave Spectral Tables Polyatomic Molecules With Internal Rotation By P F Wacker And Others
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Author : United States. National Bureau of Standards
language : en
Publisher:
Release Date : 1964
Microwave Spectral Tables Polyatomic Molecules With Internal Rotation By P F Wacker And Others written by United States. National Bureau of Standards and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1964 with Microwave spectroscopy categories.
Molecular Models For Fluids
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Author : Klaus Lucas
language : en
Publisher: Cambridge University Press
Release Date : 2007-01-22
Molecular Models For Fluids written by Klaus Lucas and has been published by Cambridge University Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007-01-22 with Technology & Engineering categories.
This book presents the development of modern molecular models for fluids from the interdisciplinary fundamentals of classical and statistical mechanics, of electrodynamics and of quantum mechanics. The concepts and working equations of the various fields are briefly derived and illustrated in the context of understanding the properties of molecular systems. Special emphasis is devoted to the quantum mechanical basis, since this is used throughout in the calculation of the molecular energy of a system. The book is application oriented. It stresses those elements that are essential for practical model development. The fundamentals are then used to derive models for various types of applications. Finally, equation of state models are presented based on quantum chemically based models for the intermolecular potential energy and perturbation theory. The book is suited for graduate courses in chemical and mechanical engineering, physics and chemistry, but may also, by proper selection, be found useful on the undergraduate level.
Molecular Symmetry Super Rotation And Semiclassical Motion
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Author : Hanno Schmiedt
language : en
Publisher: Springer
Release Date : 2017-08-31
Molecular Symmetry Super Rotation And Semiclassical Motion written by Hanno Schmiedt and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-08-31 with Science categories.
This book presents a range of fundamentally new approaches to solving problems involving traditional molecular models. Fundamental molecular symmetry is shown to open new avenues for describing molecular dynamics beyond standard perturbation techniques. Traditional concepts used to describe molecular dynamics are based on a few fundamental assumptions, the ball-and-stick picture of molecular structure and the respective perturbative treatment of different kinds of couplings between otherwise separate motions. The book points out the conceptual limits of these models and, by focusing on the most essential idea of theoretical physics, namely symmetry, shows how to overcome those limits by introducing fundamentally new concepts. The book begins with an introduction to molecular symmetry in general, followed by a discussion of nuclear spin symmetry. Here, a new correlation between identical particle exchange and spin angular momentum symmetry of nuclei is exhibited. The central part of the book is the discussion of extremely floppy molecules, which are not describable in the framework of traditional theories. The book introduces a fundamentally new approach to describing the molecular dynamics of these molecules - the super-rotor model, which is based on a five-dimensional symmetry that has never been observed in molecules before. By applying the super-rotor theory to the prototype of floppy molecules, protonated methane, this model can consistently predict the symmetry and energy of low-energy states, which were characterized experimentally only a few years ago. The theoretical predictions agree with the experimental results, which makes the prospect of further developing the super-rotor theory and applying it to other molecules a promising one. In the final section, the book also covers the topic of ultrafast rotations, where usual quantum calculations reach their natural limits. A semi-classical method for determining rotational energies, developed in the early 1990s, is shown to be attachable to quantum calculations of the vibrational states. This new combined method is suitable for efficiently calculating ro-vibrational energies, even for molecular states with large angular momentum.
Structure And Dynamics Of Non Rigid Molecular Systems
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Author : Y.G. Smeyers
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06
Structure And Dynamics Of Non Rigid Molecular Systems written by Y.G. Smeyers and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Science categories.
This volume contains a selection of scientific papers related to the structure and dynamics of non-rigid molecules. This frontline topic was born a few decades ago, when Longuet-Higgins proposed his famous theory of Molecular Symmetry Groups (Mol. Phys. 6, (1962) 457). Unfortunately, since this early paper, very few publications have been devoted to the study of non-rigid molecules. Let us mention some books which dedicate some chapters to them: Induced Representations in Crystals and Molecules, by S. L. Altmann, Academic Publishers, 1977; Molecular Symmetry and Spectroscopy, by P. R. Bunker, Academic Publishers, 1979; and finally Large Amplitude Motion in Molecules, Vols. I and II, by several authors, Springer Verlag, 1979. More recently an International Symposium on Non-Rigid Molecules was held in Paris, France, from 1-7 July 1982, the proceedings of which were published in the volume entitled Symmetries and Properties of Non-Rigid Molecules. A Comprehensive Survey, edited by J. Maruani et al., Elsevier, 1983. Finally, we should mention the very specialized work The Permutational Approach to Dynamic Stereochemistry, by J. Brocas et al., McGraw-Hill, 1983. The purpose of this book is to fill in this information on the structure and dynamics of non-rigid systems. To this aim, we have gathered a collection of recent papers written by the most qualified specialists in the world, covering a large field from van der Waals molecules to inorganic complexes and organic polyrotor molecules, as well as considering statistical and dynamic aspects.
Rotational Structure In Molecular Infrared Spectra
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Author : Carlo di Lauro
language : en
Publisher: Elsevier
Release Date : 2020-05-17
Rotational Structure In Molecular Infrared Spectra written by Carlo di Lauro and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-05-17 with Science categories.
Rotational Structure in Molecular Infrared Spectra, Second Edition, fills the gap between these complex topics and the most elementary methods in the field of rotational structure in the infrared spectra of gaseous molecules. Combining foundational theoretical information with advanced applications, this book is a useful guide for all those involved in the application of molecular spectroscopic techniques and the interpretation of vibration-rotation spectra. Interpreting vibration-rotation spectra is an important skill in many scientific disciplines, ranging from nanochemistry to planetary research, hence this book is an ideal resource. - Includes new content on the interaction of rotation and nuclear electric quadrupoles, coupled and uncoupled nuclei, and internal rotation from the high-barrier basis limit - Provides updated tables and figures throughout to support the knowledge outlined in the text - Outlines different paths through the text to help readers from different backgrounds explore the most appropriate content for their needs
Structure Of Molecules And Internal Rotation
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Author : San-Ichiro Mizushima
language : en
Publisher: Academic Press
Release Date : 2013-10-22
Structure Of Molecules And Internal Rotation written by San-Ichiro Mizushima and has been published by Academic Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-10-22 with Science categories.
Structure of Molecules and Internal Rotation reviews early studies on dihalogenoethanes. This book is organized into two parts encompassing 8 chapters that evaluate the Raman effect in ethane derivatives, the energy difference between rotational isomers, and the infrared absorption of ethane derivatives. Some of the topics covered in the book are the potential barrier to internal rotation; nature of the hindering potential; entropy difference between the rotational isomers; internal rotation in butane, pentane, and hexane; and internal rotation in long chain n-paraffins. Other chapters deal with the configuration of a polypeptide chain, as well as the sum rule and the product rule for rotational isomers. The normal vibrations of the 1,2-dihalogenoethanes are presented. The last chapters are devoted to the examination of the Raman effect, dielectric constant, and electron diffraction. The book can provide useful information to chemists, physicists, students, and researchers.
Molecular Structure And Statistical Thermodynamics
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Author : Kenneth S. Pitzer
language : en
Publisher: World Scientific
Release Date : 1993
Molecular Structure And Statistical Thermodynamics written by Kenneth S. Pitzer and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 1993 with Science categories.
This book considers molecular structural information, statistical methods and thermodynamic measurements, and the ways in which the relative role of each differs from another. By putting together selected papers in a single publication, the book highlights the cohesive aspects of certain advances through time and development, and can aid historical studies. Several papers from journals not widely circulated can also be found in this selection of papers.