Molecular Vibrations: An Algebraic And Nonlinear Approach
Molecular Vibrations: An Algebraic And Nonlinear Approach

Author: Guozhen Wu

Publisher: World Scientific

Published: 2018-08-07

Total Pages: 248

ISBN-13: 9813270713

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This book focuses on the main idea that highly-excited molecular vibration is a nonlinear, many-body and semiclassical system. Therefore, many ideas and techniques in nonlinear fields such as chaos, resonance, Lyapunov exponent, etc. can be incorporated into this study. Together with the Lie algebraic coset algorithm, readers are able to approach the topics in a simple arithmetic and realistic way in contrast to the traditional solving of Schrödinger equation.Covering the author's research in over two decades, these works bridge the gaps between molecular vibration and nonlinear sciences, many new characters are introduced for molecular highly-excited vibration from a fresh viewpoint of nonlinearity, especially, the chaos. Related works of the elementary ideas in this field can be found in the first three chapters for the readers to be familiar with, while the rest of the chapters offer concrete examples with flourishing ideas and results on system dynamics which are not known or neglected by the traditional wave function algorithm.

Normal Modes and Localization in Nonlinear Systems
Normal Modes and Localization in Nonlinear Systems

Author: Alexander F. Vakakis

Publisher: Springer Science & Business Media

Published: 2013-06-29

Total Pages: 290

ISBN-13: 9401724520

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The nonlinear normal modes of a parametrically excited cantilever beam are constructed by directly applying the method of multiple scales to the governing integral-partial differential equation and associated boundary conditions. The effect of the inertia and curvature nonlin earities and the parametric excitation on the spatial distribution of the deflection is examined. The results are compared with those obtained by using a single-mode discretization. In the absence of linear viscous and quadratic damping, it is shown that there are nonlinear normal modes, as defined by Rosenberg, even in the presence of a principal parametric excitation. Furthermore, the nonlinear mode shape obtained with the direct approach is compared with that obtained with the discretization approach for some values of the excitation frequency. In the single-mode discretization, the spatial distribution of the deflection is assumed a priori to be given by the linear mode shape ¢n, which is parametrically excited, as Equation (41). Thus, the mode shape is not influenced by the nonlinear curvature and nonlinear damping. On the other hand, in the direct approach, the mode shape is not assumed a priori; the nonlinear effects modify the linear mode shape ¢n. Therefore, in the case of large-amplitude oscillations, the single-mode discretization may yield inaccurate mode shapes. References 1. Vakakis, A. F., Manevitch, L. I., Mikhlin, Y. v., Pilipchuk, V. N., and Zevin A. A., Nonnal Modes and Localization in Nonlinear Systems, Wiley, New York, 1996.

Algebraic Theory of Molecules
Algebraic Theory of Molecules

Author: F. Iachello

Publisher: Oxford University Press, USA

Published: 1995

Total Pages: 262

ISBN-13: 0195080912

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Algebraic Theory of Molecules presents a fresh look at the mathematics of wave functions that provide the theoretical underpinnings of molecular spectroscopy. Written by renowned authorities in the field, the book demonstrates the advantages of algebraic theory over the more conventional geometric approach to developing the formal quantum mechanics inherent in molecular spectroscopy. Many examples are provided that compare the algebraic and geometric methods, illustrating the relationship between the algebraic approach and current experiments. The authors develop their presentation from a basic level so as to enable newcomers to enter the field while providing enough details and concrete examples to serve as a reference for the expert. Chemical physicists, physical chemists, and spectroscopists will want to read this exciting new approach to molecular spectroscopy.

The Mechanics of Nonlinear Systems with Internal Resonances
The Mechanics of Nonlinear Systems with Internal Resonances

Author: Arkadiy I. Manevich

Publisher: World Scientific

Published: 2005

Total Pages: 278

ISBN-13: 1860945104

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One of the most important features of nonlinear systems with several degrees of freedom is the presence of internal resonances at certain relations between natural frequencies of different modes. This monograph is the first book devoted predominantly to internal resonances in different mechanical systems including those of practical importance.The main purpose is to consider the internal resonances from the general point of view and to elucidate their role in applied nonlinear dynamics by using an efficient approach based on introducing the complex representation of equations of motion (together with the multiple scale method). Considered here are autonomous and nonautonomous discrete two-degree-of-freedom systems, infinite chains of particles, and continuous systems, including circular rings and cylindrical shells. Specific attention is paid to the case of one-to-one internal resonance in systems with cubic nonlinearities. Steady-state and nonstationary regimes of motion, interaction of the internal and external resonances at forced oscillations, and bifurcations of steady-state modes and their stability are systematically studied.

Nonlinearity and Chaos in Molecular Vibrations
Nonlinearity and Chaos in Molecular Vibrations

Author: Guozhen Wu

Publisher: Elsevier

Published: 2005-07-01

Total Pages: 321

ISBN-13: 0080459072

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Nonlinearity and Chaos in Molecular Vibrations deals systematically with a Lie algebraic approach to the study of nonlinear properties of molecular highly excited vibrations. The fundamental concepts of nonlinear dynamics such as chaos, fractals, quasiperiodicity, resonance, and the Lyapunov exponent, and their roles in the study of molecular vibrations are presented.The 20 chapters cover the basic ideas, the concept of dynamical groups, the integrable two-mode SU(2) system, the unintegrable three-mode SU(3) system, the noncompact su(1,1) algebraic application, su(3) symmetry breaking and its application and the quantal effect of asymmetric molecular rotation. Emphasis is given to: resonance and chaos, the fractal structure of eigencoefficients, the C-H bend motion of acetylene, regular and chaotic motion of DCN, the existence of approximately conserved quantum numbers, one-electronic motion in multi-sites, the Lyapunov exponent, actions of periodic trajectories and quantization, the H function and its application in vibrational relaxation as well as the Dixon dip and its destruction and chaos in the transitional states. This approach bridges the gap between molecular vibrational spectroscopy and nonlinear dynamics.The book presents a framework of information that readers can use to build their knowledge, and is therefore highly recommended for all those working in or studying molecular physics, molecular spectroscopy, chemical physics and theoretical physics.* Discusses nonlinearity and chaotic phenomena in molecular vibrations* Approaches the complicated highly excited molecular vibration* Provides clear information for students and researchers looking to expand knowledge in this field

Novel Approaches to the Structure and Dynamics of Liquids: Experiments, Theories and Simulations
Novel Approaches to the Structure and Dynamics of Liquids: Experiments, Theories and Simulations

Author: Jannis Samios

Publisher: Springer Science & Business Media

Published: 2013-11-11

Total Pages: 548

ISBN-13: 1402023847

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The unique behavior of the "liquid state", together with the richness of phenomena that are observed, render liquids particularly interesting for the scientific community. Note that the most important reactions in chemical and biological systems take place in solutions and liquid-like environments. Additionally, liquids are utilized for numerous industrial applications. It is for these reasons that the understanding of their properties at the molecular level is of foremost interest in many fields of science and engineering. What can be said with certainty is that both the experimental and theoretical studies of the liquid state have a long and rich history, so that one might suppose this to be essentially a solved problem. It should be emphasized, however, that although, for more than a century, the overall scientific effort has led to a considerable progress, our understanding of the properties of the liquid systems is still incomplete and there is still more to be explored. Basic reason for this is the "many body" character of the particle interactions in liquids and the lack of long-range order, which introduce in liquid state theory and existing simulation techniques a number of conceptual and technical problems that require specific approaches. Also, many of the elementary processes that take place in liquids, including molecular translational, rotational and vibrational motions (Trans. -Rot. -Vib. coupling), structural relaxation, energy dissipation and especially chemical changes in reactive systems occur at different and/or extremely short timescales.

Perspectives in Dynamical Systems II: Mathematical and Numerical Approaches
Perspectives in Dynamical Systems II: Mathematical and Numerical Approaches

Author: Jan Awrejcewicz

Publisher: Springer Nature

Published: 2022-01-01

Total Pages: 297

ISBN-13: 3030773108

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This volume is part of collection of contributions devoted to analytical and experimental techniques of dynamical systems, presented at the 15th International Conference “Dynamical Systems: Theory and Applications”, held in Łódź, Poland on December 2-5, 2019. The wide selection of material has been divided into three volumes, each focusing on a different field of applications of dynamical systems. The broadly outlined focus of both the conference and these books includes bifurcations and chaos in dynamical systems, asymptotic methods in nonlinear dynamics, dynamics in life sciences and bioengineering, original numerical methods of vibration analysis, control in dynamical systems, optimization problems in applied sciences, stability of dynamical systems, experimental and industrial studies, vibrations of lumped and continuous systems, non-smooth systems, engineering systems and differential equations, mathematical approaches to dynamical systems, and mechatronics.

Laser Spectroscopy of Highly Vibrationally Excited Molecules
Laser Spectroscopy of Highly Vibrationally Excited Molecules

Author: Vladilen Stepanovich Letokhov

Publisher: CRC Press

Published: 2021-07-28

Total Pages: 397

ISBN-13: 1000445127

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Laser spectroscopy has been perfected over the last fifteen years to become a precise tool for the investigation of highly vibrationally excited molecules. Intense infrared laser radiation permits both the multiple-photon resonant excitation and the dissociation of polyatomic molecules. In this book, the latest results of some of the foremost Soviet researchers are published for the first time in the West. Laser Spectroscopy of Highly Vibrationally Excited Molecules contains a comprehensive study of both the experimental and theoretical aspects of the basic photophysical interactions that occur in these processes. The book first focuses on the nonlinear interaction between the resonant vibrational mode and the intense infrared field and then examines the nonlinear interaction between the vibrational modes themselves due to anharmonicity. These interrelated processes determine all the characteristics of polyatomic molecules in an infrared field. The book also discusses related phenomena such as spectra broadening, optical resonance, photon echoes, and dynamical chaos. It includes examples of multiple-photon resonant excitation such as the excitation of OsO4 by CO^O2 laser radiation, which is detected by the visible luminescence that results. This book will be of great interest to researchers and postgraduate students in infrared laser spectroscopy and the laser chemistry of molecules and applications of isotope separation.

Quantum Systems in Physics, Chemistry and Biology - Theory, Interpretation and Results
Quantum Systems in Physics, Chemistry and Biology - Theory, Interpretation and Results

Author:

Publisher: Academic Press

Published: 2019-01-05

Total Pages: 488

ISBN-13: 0128160853

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Quantum Systems in Physics, Chemistry and Biology, Theory, Interpretation, and Results, Volume 78, the latest release in the Advances in Quantum Chemistry series 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. - 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