Molecular Spectroscopy and Quantum Dynamics

Molecular Spectroscopy and Quantum Dynamics
Author: Roberto Marquardt,Martin Quack
Publsiher: Unknown
Total Pages: 380
Release: 2019-09
ISBN 10: 9780128172346
ISBN 13: 0128172347
Language: EN, FR, DE, ES & NL

Molecular Spectroscopy and Quantum Dynamics Book Review:

Molecular Spectroscopy and Quantum Dynamics, an exciting new work edited by Professors Martin Quack and Roberto Marquardt, contains comprehensive information on the current state-of-the-art experimental and theoretical methods and techniques used to unravel ultra-fast phenomena in atoms, molecules and condensed matter, along with future perspectives on the field. Contains new insights into the dynamics and spectroscopy of electronic and nuclear motion Presents the most recent developments in the detection and interpretation of ultra-fast phenomena Includes a conversation on the importance of these phenomena for the understanding of chemical reaction kinetics and the variation of molecular structure

Molecular Quantum Dynamics

Molecular Quantum Dynamics
Author: Fabien Gatti
Publsiher: Springer Science & Business Media
Total Pages: 273
Release: 2014-04-09
ISBN 10: 3642452906
ISBN 13: 9783642452901
Language: EN, FR, DE, ES & NL

Molecular Quantum Dynamics Book Review:

This book focuses on current applications of molecular quantum dynamics. Examples from all main subjects in the field, presented by the internationally renowned experts, illustrate the importance of the domain. Recent success in helping to understand experimental observations in fields like heterogeneous catalysis, photochemistry, reactive scattering, optical spectroscopy, or femto- and attosecond chemistry and spectroscopy underline that nuclear quantum mechanical effects affect many areas of chemical and physical research. In contrast to standard quantum chemistry calculations, where the nuclei are treated classically, molecular quantum dynamics can cover quantum mechanical effects in their motion. Many examples, ranging from fundamental to applied problems, are known today that are impacted by nuclear quantum mechanical effects, including phenomena like tunneling, zero point energy effects, or non-adiabatic transitions. Being important to correctly understand many observations in chemical, organic and biological systems, or for the understanding of molecular spectroscopy, the range of applications covered in this book comprises broad areas of science: from astrophysics and the physics and chemistry of the atmosphere, over elementary processes in chemistry, to biological processes (such as the first steps of photosynthesis or vision). Nevertheless, many researchers refrain from entering this domain. The book "Molecular Quantum Dynamics" offers them an accessible introduction. Although the calculation of large systems still presents a challenge - despite the considerable power of modern computers - new strategies have been developed to extend the studies to systems of increasing size. Such strategies are presented after a brief overview of the historical background. Strong emphasis is put on an educational presentation of the fundamental concepts, so that the reader can inform himself about the most important concepts, like eigenstates, wave packets, quantum mechanical resonances, entanglement, etc. The chosen examples highlight that high-level experiments and theory need to work closely together. This book thus is a must-read both for researchers working experimentally or theoretically in the concerned fields, and generally for anyone interested in the exciting world of molecular quantum dynamics.

Symmetry of Intramolecular Quantum Dynamics

Symmetry of Intramolecular Quantum Dynamics
Author: Alexander V. Burenin
Publsiher: Walter de Gruyter
Total Pages: 443
Release: 2013-01-01
ISBN 10: 3110267640
ISBN 13: 9783110267648
Language: EN, FR, DE, ES & NL

Symmetry of Intramolecular Quantum Dynamics Book Review:

The main goal of this book is to give a systematic description of intramolecular quantum dynamics on the basis of only the symmetry principles. In this respect, the book has no analogs in the world literature. The obtained models lead to a simple, purely algebraic, scheme of calculation and are rigorous in the sense that their correctness is limited only to the correct choice of symmetry of the internal dynamics. The book is basically intended for scientists working in the field of molecular spectroscopy, quantum and structural chemistry.

Advances in the Theory of Atomic and Molecular Systems

Advances in the Theory of Atomic and Molecular Systems
Author: Piotr Piecuch,Jean Maruani,Gerardo Delgado-Barrio,Stephen Wilson
Publsiher: Springer Science & Business Media
Total Pages: 288
Release: 2009-09-30
ISBN 10: 9048129850
ISBN 13: 9789048129850
Language: EN, FR, DE, ES & NL

Advances in the Theory of Atomic and Molecular Systems Book Review:

Advances in the Theory of Atomic and Molecular Systems, is a collection of contributions presenting recent theoretical and computational developments that provide new insights into the structure, properties, and behavior of a variety of atomic and molecular systems. This volume (subtitled “Dynamics, Spectroscopy, Clusters, and Nanostructures”) deals with the topics of “Quantum Dynamics and Spectroscopy”, “Complexes and Clusters”, and “Nanostructures and Complex Systems”. This volume is an invaluable resource for faculty, graduate students, and researchers interested in theoretical and computational chemistry and physics, physical chemistry and chemical physics, molecular spectroscopy, and related areas of science and engineering.

Molecular Spectroscopy and Quantum Dynamics

Molecular Spectroscopy and Quantum Dynamics
Author: Roberto Marquardt,Martin Quack
Publsiher: Elsevier
Total Pages: 374
Release: 2020-09-30
ISBN 10: 0128172355
ISBN 13: 9780128172353
Language: EN, FR, DE, ES & NL

Molecular Spectroscopy and Quantum Dynamics Book Review:

Molecular Spectroscopy and Quantum Dynamics, an exciting new work edited by Professors Martin Quack and Roberto Marquardt, contains comprehensive information on the current state-of-the-art experimental and theoretical methods and techniques used to unravel ultra-fast phenomena in atoms, molecules and condensed matter, along with future perspectives on the field. Contains new insights into the dynamics and spectroscopy of electronic and nuclear motion Presents the most recent developments in the detection and interpretation of ultra-fast phenomena Includes a conversation on the importance of these phenomena for the understanding of chemical reaction kinetics and the variation of molecular structure

Quantum Dynamics of Molecules

Quantum Dynamics of Molecules
Author: R. G. Woolley
Publsiher: Springer Science & Business Media
Total Pages: 557
Release: 2013-06-29
ISBN 10: 1468437372
ISBN 13: 9781468437379
Language: EN, FR, DE, ES & NL

Quantum Dynamics of Molecules Book Review:

The Advanced Study Institute on "Quantum Dynamics of Molecules: The New Experimental Challenge to Theorists," which was sponsored by the Scientific Affairs Division of NATO, was held at Trinity Hall, Ca~bridge, England from September 15th till September 29th, 1979. In all, a total of 79 lecturers and students attended the meeting: they had diverse backgrounds in chemistry, physics and mathematics. In my proposal to NATO requesting financial support for an Advanced Study Institute, I suggested that molecular physics was facing a qualitatively new experimental situation in which the exploration of previously inaccessible dynamical phenomena would become of increasing importance. At the same time I was aware that in recent years powerful theoretical techniques, that might prove crucial tools for the interpretation of the new experiments, have been developed in mathematics and theoretical physics. The aim of the ASI was to review at an advanced level these recent developments, juxtaposing new theory with new experimental pos sibilities in the hope that the participants in the-Institute would through their subsequent work increase the awareness of the whole molecular theory community of the changing nature of chemical physics. The recent developments in laser spectroscopy, particle scatter ing experiments and molecular beam technology imply that an entirely new class of phenomena involving molecules in gasses and liquids can now be investigated.

Basic Molecular Quantum Mechanics

Basic Molecular Quantum Mechanics
Author: Steven A. Adelman
Publsiher: CRC Press
Total Pages: 464
Release: 2021-08-01
ISBN 10: 1498734006
ISBN 13: 9781498734004
Language: EN, FR, DE, ES & NL

Basic Molecular Quantum Mechanics Book Review:

Quantum mechanics is a general theory of the motions, structures, properties, and behaviors of particles of atomic and subatomic dimensions. While quantum mechanics was created in the first third of the twentieth century by a handful of theoretical physicists working on a limited number of problems, it has further developed and is now applied by a great number of people working on a vast range of problems in wide areas of science and technology. Basic Molecular Quantum Mechanics introduces quantum mechanics by covering the fundamentals of quantum mechanics and some of its most important chemical applications: vibrational and rotational spectroscopy and electronic structure of atoms and molecules. Thoughtfully organized, the author builds up quantum mechanics systematically with each chapter preparing the student for the more advanced chapters and complex applications. Additional features include the following: This book presents rigorous and precise explanations of quantum mechanics and mathematical proofs. It contains qualitative discussions of key concepts with mathematics presented in the appendices. It provides problems and solutions at the end of each chapter to encourage understanding and application. This book is carefully written to emphasize its applications to chemistry and is a valuable resource for advanced undergraduates and beginning graduate students specializing in chemistry, in related fields such as chemical engineering and materials science, and in some areas of biology.

Molecular Excitation Dynamics and Relaxation

Molecular Excitation Dynamics and Relaxation
Author: Leonas Valkunas,Darius Abramavicius,Tomás Mancal
Publsiher: John Wiley & Sons
Total Pages: 470
Release: 2013-10-04
ISBN 10: 3527653678
ISBN 13: 9783527653676
Language: EN, FR, DE, ES & NL

Molecular Excitation Dynamics and Relaxation Book Review:

This work brings together quantum theory and spectroscopy to convey excitation processes to advanced students and specialists wishing to conduct research and understand the entire fi eld rather than just single aspects. Written by experienced authors and recognized authorities in the field, this text covers numerous applications and offers examples taken from different disciplines. As a result, spectroscopists, molecular physicists, physical chemists, and biophysicists will all fi nd this a must-have for their research. Also suitable as supplementary reading in graduate level courses.

Ultrafast Spectroscopy of Atomic and Molecular Quantum Dynamics

Ultrafast Spectroscopy of Atomic and Molecular Quantum Dynamics
Author: Pia Johansson
Publsiher: Unknown
Total Pages: 100
Release: 2006
ISBN 10: 9789171553140
ISBN 13: 9171553142
Language: EN, FR, DE, ES & NL

Ultrafast Spectroscopy of Atomic and Molecular Quantum Dynamics Book Review:

The Semiclassical Way to Dynamics and Spectroscopy

The Semiclassical Way to Dynamics and Spectroscopy
Author: Eric J. Heller
Publsiher: Princeton University Press
Total Pages: 472
Release: 2018-06-05
ISBN 10: 0691163731
ISBN 13: 9780691163734
Language: EN, FR, DE, ES & NL

The Semiclassical Way to Dynamics and Spectroscopy Book Review:

A graduate-level text that examines the semiclassical approach to quantum mechanics Physical systems have been traditionally described in terms of either classical or quantum mechanics. But in recent years, semiclassical methods have developed rapidly, providing deep physical insight and computational tools for quantum dynamics and spectroscopy. In this book, Eric Heller introduces and develops this subject, demonstrating its power with many examples. In the first half of the book, Heller covers relevant aspects of classical mechanics, building from them the semiclassical way through the semiclassical limit of the Feynman path integral. The second half of the book applies this approach to various kinds of spectroscopy, such as molecular spectroscopy and electron imaging and quantum dynamical systems with an emphasis on tunneling. Adopting a distinctly time-dependent viewpoint, Heller argues for semiclassical theories from experimental and theoretical vantage points valuable to research in physics and chemistry. Featuring more than two hundred figures, the book provides a geometric, phase-space, and coordinate-space pathway to greater understanding. Filled with practical examples and applications, The Semiclassical Way to Dynamics and Spectroscopy is a comprehensive presentation of the tools necessary to successfully delve into this unique area of quantum mechanics. A comprehensive approach for using classical mechanics to do quantum mechanics More than two hundred figures to assist intuition Emphasis on semiclassical Green function and wave packet perspective, as well as tunneling and spectroscopy Chapters include quantum mechanics of classically chaotic systems, quantum scarring, and other modern dynamical topics

Advances in the Theory of Atomic and Molecular Systems

Advances in the Theory of Atomic and Molecular Systems
Author: Piotr Piecuch,Jean Maruani,Gerardo Delgado-Barrio,Stephen Wilson
Publsiher: Springer
Total Pages: 448
Release: 2011-11-29
ISBN 10: 9789048125975
ISBN 13: 9048125979
Language: EN, FR, DE, ES & NL

Advances in the Theory of Atomic and Molecular Systems Book Review:

Advances in the Theory of Atomic and Molecular Systems, is a collection of contributions presenting recent theoretical and computational developments that provide new insights into the structure, properties, and behavior of a variety of atomic and molecular systems. This volume (subtitled: Conceptual and Computational Advances in Quantum Chemistry) focuses on electronic structure theory and its foundations. This volume is an invaluable resource for faculty, graduate students, and researchers interested in theoretical and computational chemistry and physics, physical chemistry and chemical physics, molecular spectroscopy, and related areas of science and engineering.

Spectroscopy and Dynamics of Single Molecules

Spectroscopy and Dynamics of Single Molecules
Author: Anonim
Publsiher: Elsevier
Total Pages: 402
Release: 2019-08-14
ISBN 10: 0128164646
ISBN 13: 9780128164648
Language: EN, FR, DE, ES & NL

Spectroscopy and Dynamics of Single Molecules Book Review:

Spectroscopy and Dynamics of Single Molecules: Methods and Applications reviews the most recent developments in spectroscopic methods and applications. Spectroscopic techniques are the chief experimental methods for testing theoretical models and research in this area plays an important role in stimulating new theoretical developments in physical chemistry. This book provides an authoritative insight into the latest advances in the field, highlighting new techniques, current applications, and potential future developments An ideal reference for chemists and physicists alike, Spectroscopy and Dynamics of Single Molecules: Methods and Applications is a useful guide for all those working in the research, design, or application of spectroscopic tools and techniques across a wide range of fields. Includes the latest research on ultrafast vibrational and electronic dynamics, nonlinear spectroscopies, and single-molecule methods Makes the content accessible to researchers in chemistry, biophysics, and chemical physics through a rigorous multi-disciplinary approach Provides content edited by a world-renowned chemist with more than 30 years of experience in research and instruction

Fundamentals of Quantum Chemistry

Fundamentals of Quantum Chemistry
Author: Michael P. Mueller
Publsiher: Springer Science & Business Media
Total Pages: 265
Release: 2007-05-08
ISBN 10: 0306475669
ISBN 13: 9780306475665
Language: EN, FR, DE, ES & NL

Fundamentals of Quantum Chemistry Book Review:

As quantum theory enters its second century, it is fitting to examine just how far it has come as a tool for the chemist. Beginning with Max Planck’s agonizing conclusion in 1900 that linked energy emission in discreet bundles to the resultant black-body radiation curve, a body of knowledge has developed with profound consequences in our ability to understand nature. In the early years, quantum theory was the providence of physicists and certain breeds of physical chemists. While physicists honed and refined the theory and studied atoms and their component systems, physical chemists began the foray into the study of larger, molecular systems. Quantum theory predictions of these systems were first verified through experimental spectroscopic studies in the electromagnetic spectrum (microwave, infrared and ultraviolet/visible), and, later, by nuclear magnetic resonance (NMR) spectroscopy. Over two generations these studies were hampered by two major drawbacks: lack of resolution of spectroscopic data, and the complexity of calculations. This powerful theory that promised understanding of the fundamental nature of molecules faced formidable challenges. The following example may put things in perspective for today’s chemistry faculty, college seniors or graduate students: As little as 40 years ago, force field calculations on a molecule as simple as ketene was a four to five year dissertation project.

Molecular Spectroscopy

Molecular Spectroscopy
Author: Yukihiro Ozaki,Marek Januz Wójcik,Jürgen Popp
Publsiher: John Wiley & Sons
Total Pages: 448
Release: 2019-04-26
ISBN 10: 3527814604
ISBN 13: 9783527814602
Language: EN, FR, DE, ES & NL

Molecular Spectroscopy Book Review:

Uniquely creates a strong bridge between molecular spectroscopy and quantum chemistry This two-volume book consists of many reviews reporting new applications of quantum chemistry to molecular spectroscopy (Raman, infrared, near-infrared, terahertz, far-ultraviolet, etc.). It contains brief introductions to quantum chemistry for spectroscopists, and to the recent progress on molecular spectroscopy for quantum chemists. Molecular Spectroscopy: A Quantum Chemistry Approach examines the recent progress made in the field of molecular spectroscopy; the state of the art of quantum chemistry for molecular spectroscopy; and more. It offers multiple chapters covering the application of quantum chemistry to: visible absorption and fluorescence, Raman spectroscopy, infrared spectroscopy, near-infrared spectroscopy, terahertz spectroscopy, and far-ultraviolet spectroscopy. It presents readers with hydrogen bonding studies by vibrational spectroscopy and quantum chemistry, as well as vibrational spectroscopy and quantum chemistry studies on both biological systems and nano science. The book also looks at vibrational anharmonicity and overtones, and nonlinear and time-resolved spectroscopy. -Comprehensively covers existing and recent applications of quantum chemistry to molecular spectroscopy -Introduces the quantum chemistry for the field of spectroscopy and the advancements being made on molecular spectroscopy for quantum chemistry -Edited by world leading experts who have long standing, extensive experience and international standing in the field Molecular Spectroscopy: A Quantum Chemistry Approach is an ideal book for analytical chemists, theoretical chemists, chemists, biochemists, materials scientists, biologists, and physicists interested in the subject.

Quantum Mechanics in Chemistry

Quantum Mechanics in Chemistry
Author: Melvin W. Hanna,Melvin W.. Hanna
Publsiher: Addison Wesley Longman
Total Pages: 260
Release: 1969
ISBN 10: 1928374650XXX
ISBN 13: UOM:39015016098736
Language: EN, FR, DE, ES & NL

Quantum Mechanics in Chemistry Book Review:

Includes bibliographical references.

Gas Phase Molecular Dynamics

Gas Phase Molecular Dynamics
Author: Anonim
Publsiher: Unknown
Total Pages: 135
Release: 2010
ISBN 10: 1928374650XXX
ISBN 13: OCLC:727255252
Language: EN, FR, DE, ES & NL

Gas Phase Molecular Dynamics Book Review:

The goal of this program is the development and application of computational methods for studying chemical reaction dynamics and molecular spectroscopy in the gas phase. We are interested in developing rigorous quantum dynamics algorithms for small polyatomic systems and in implementing approximate approaches for complex ones. Particular focus is on the dynamics and kinetics of chemical reactions and on the rovibrational spectra of species involved in combustion processes. This research also explores the potential energy surfaces of these systems of interest using state-of-the-art quantum chemistry methods.

The Spectra and Dynamics of Diatomic Molecules

The Spectra and Dynamics of Diatomic Molecules
Author: Helene Lefebvre-Brion,Robert W. Field
Publsiher: Elsevier
Total Pages: 786
Release: 2004-04-28
ISBN 10: 0080517501
ISBN 13: 9780080517506
Language: EN, FR, DE, ES & NL

The Spectra and Dynamics of Diatomic Molecules Book Review:

This book is written for graduate students just beginning research, for theorists curious about what experimentalists actually can and do measure, and for experimentalists bewildered by theory. It is a guide for potential users of spectroscopic data, and uses language and concepts that bridge the frequency-and time-domain spectroscopic communities. Key topics, concepts, and techniques include: the assignment of simple spectra, basic experimental techniques, definition of Born-Oppenheimer and angular momentum basis sets and the associated spectroscopic energy level patterns (Hund's cases), construction of effective Hamiltonian matrices to represent both spectra and dynamics, terms neglected in the Born-Oppenheimer approximation (situations intermediate between Hund's cases, spectroscopic perturbations), nonlinear least squares fitting, calculation and interpretation of coupling terms, semi-classical (WKB) approximation, transition intensities and interference effects, direct photofragmentation (dissociation and ionization) and indirect photofragmentation (predissociation and autoionization) processes, visualization of intramolecular dynamics, quantum beats and wavepackets, treatment of decaying quasi-eigenstates using a complex Heff model, and concluding with some examples of polyatomic molecule dynamics. Students will discover that there is a fascinating world of cause-and-effect localized dynamics concealed beyond the reduction of spectra to archival molecular constants and the exact ab initio computation of molecular properties. Professional spectroscopists, kinetics, ab initio theorists will appreciate the practical, simplified-model, and rigorous theoretical approaches discussed in this book. Key Features: • A fundamental reference for all spectra of small, gas-phase molecules. • It is the most up-to-date and comprehensive book on the electronic spectroscopy and dynamics of diatomic molecules. • The authors pioneered the development of many of the experimental methods, concepts, models, and computational schemes described in this book. A fundamental reference for all spectra of small, gas-phase molecules. It is the most up-to-date and comprehensive book on the electronic spectroscopy and dynamics of diatomic molecules. The authors pioneered the development of many of the experimental methods, concepts, models, and computational schemes described in this book.

Spectra and Dynamics of Small Molecules

Spectra and Dynamics of Small Molecules
Author: Robert W. Field
Publsiher: Springer
Total Pages: 153
Release: 2015-04-14
ISBN 10: 3319159585
ISBN 13: 9783319159584
Language: EN, FR, DE, ES & NL

Spectra and Dynamics of Small Molecules Book Review:

These seven lectures are intended to serve as an introduction for beginning graduate students to the spectra of small molecules. The author succeeds in illustrating the concepts by using language and metaphors that capture and elegantly convey simple insights into dynamics that lie beyond archival molecular constants. The lectures can simultaneously be viewed as a collection of interlocking special topics that have fascinated the author and his students over the years. Though neither a textbook nor a scholarly monograph, the book provides an illuminating perspective that will benefit students and researchers alike.

Many Particle Quantum Dynamics in Atomic and Molecular Fragmentation

Many Particle Quantum Dynamics in Atomic and Molecular Fragmentation
Author: Joachim Ullrich,V.P. Shevelko
Publsiher: Springer Science & Business Media
Total Pages: 515
Release: 2013-06-29
ISBN 10: 3662084929
ISBN 13: 9783662084922
Language: EN, FR, DE, ES & NL

Many Particle Quantum Dynamics in Atomic and Molecular Fragmentation Book Review:

This is the first comprehensive treatment of the interactions of atoms and molecules with charged particles, photons and laser fields. Addressing the subject from a unified viewpoint, the volume reflects our present understanding of many-particle dynamics in rearrangement and fragmentation reactions.

Spectroscopy Quantum Dynamics and Parity Violation in Axially Chiral Molecules

Spectroscopy  Quantum Dynamics and Parity Violation in Axially Chiral Molecules
Author: Michael Gottselig
Publsiher: Unknown
Total Pages: 248
Release: 2004
ISBN 10: 1928374650XXX
ISBN 13: OCLC:85337704
Language: EN, FR, DE, ES & NL

Spectroscopy Quantum Dynamics and Parity Violation in Axially Chiral Molecules Book Review: