Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy

Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy
Author: Michel Herman
Publisher: John Wiley & Sons
Total Pages: 448
Release: 2009-09-09
Genre: Science
ISBN: 0470142200

The latest in a series providing chemical physicists with a forum for critical, authoritative evaluations of advances in every area of the discipline, this stand-alone volume focuses on using high resolution molecular spectroscopy to arrive at global and accurate Vibration Hamiltonians.

Advances in Chemical Physics, Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy

Advances in Chemical Physics, Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy
Author: Michel Herman
Publisher: Wiley-Interscience
Total Pages: 448
Release: 2006-12-01
Genre: Science
ISBN: 9780470141670

The latest in a series providing chemical physicists with a forum for critical, authoritative evaluations of advances in every area of the discipline, this stand-alone volume focuses on using high resolution molecular spectroscopy to arrive at global and accurate Vibration Hamiltonians.

Advances in Chemical Physics, Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy

Advances in Chemical Physics, Global and Accurate Vibration Hamiltonians from High-Resolution Molecular Spectroscopy
Author: Michel Herman
Publisher: Wiley-Interscience
Total Pages: 448
Release: 2006-12-01
Genre: Science
ISBN: 9780470141670

The latest in a series providing chemical physicists with a forum for critical, authoritative evaluations of advances in every area of the discipline, this stand-alone volume focuses on using high resolution molecular spectroscopy to arrive at global and accurate Vibration Hamiltonians.

Handbook of High-resolution Spectroscopy

Handbook of High-resolution Spectroscopy
Author: Martin Quack
Publisher: John Wiley & Sons
Total Pages: 2236
Release: 2011-09-26
Genre: Science
ISBN: 0470066539

The field of High-Resolution Spectroscopy has been considerably extended and even redefined in some areas. Combining the knowledge of spectroscopy, laser technology, chemical computation, and experiments, Handbook of High-Resolution Spectroscopy provides a comprehensive survey of the whole field as it presents itself today, with emphasis on the recent developments. This essential handbook for advanced research students, graduate students, and researchers takes a systematic approach through the range of wavelengths and includes the latest advances in experiment and theory that will help and guide future applications. The first comprehensive survey in high-resolution molecular spectroscopy for over 15 years Brings together the knowledge of spectroscopy, laser technology, chemical computation and experiments Brings the reader up-to-date with the many advances that have been made in recent times Takes the reader through the range of wavelengths, covering all possible techniques such as Microwave Spectroscopy, Infrared Spectroscopy, Raman Spectroscopy, VIS, UV and VUV Combines theoretical, computational and experimental aspects Has numerous applications in a wide range of scientific domains Edited by two leaders in this field Provides an overview of rotational, vibration, electronic and photoelectron spectroscopy Volume 1 - Introduction: Fundamentals of Molecular Spectroscopy Volume 2 - High-Resolution Molecular Spectroscopy: Methods and Results Volume 3 - Special Methods & Applications

Accurate Structure Determination of Free Molecules

Accurate Structure Determination of Free Molecules
Author: Jean Demaison
Publisher: Springer Nature
Total Pages: 291
Release: 2020-12-02
Genre: Science
ISBN: 3030604926

This book presents a detailed look at experimental and computational techniques for accurate structure determination of free molecules. The most fundamental property of a molecule is its structure – it is a prerequisite for determining and understanding most other important properties of molecules. The determination of accurate structures is hampered by a myriad of factors, subjecting the collected data to non-negligible systematic errors. This book explains the origin of these errors and how to mitigate and even avoid them altogether. It features a detailed comparison of the different experimental and computation methods, explaining their interplay and the advantages of their combined use. Armed with this information, the reader will be able to choose the appropriate methods to determine – to a great degree of accuracy – the relevant molecular structure.

Nonlinear Hamiltonian Mechanics Applied to Molecular Dynamics

Nonlinear Hamiltonian Mechanics Applied to Molecular Dynamics
Author: Stavros C. Farantos
Publisher: Springer
Total Pages: 165
Release: 2014-09-22
Genre: Science
ISBN: 3319099884

This brief presents numerical methods for describing and calculating invariant phase space structures, as well as solving the classical and quantum equations of motion for polyatomic molecules. Examples covered include simple model systems to realistic cases of molecules spectroscopically studied. Vibrationally excited and reacting molecules are nonlinear dynamical systems, and thus, nonlinear mechanics is the proper theory to elucidate molecular dynamics by investigating invariant structures in phase space. Intramolecular energy transfer, and the breaking and forming of a chemical bond have now found a rigorous explanation by studying phase space structures.

Isotope Effects In Chemistry and Biology

Isotope Effects In Chemistry and Biology
Author: Amnon Kohen
Publisher: CRC Press
Total Pages: 1092
Release: 2005-11-01
Genre: Medical
ISBN: 1420028022

The field of isotope effects has expanded exponentially in the last decade, and researchers are finding isotopes increasingly useful in their studies. Bringing literature on the subject up to date, Isotope Effects in Chemistry and Biology covers current principles, methods, and a broad range of applications of isotope effects in the physical, biolo

Molecular Reaction Dynamics

Molecular Reaction Dynamics
Author: Raphael D. Levine
Publisher: Cambridge University Press
Total Pages: 574
Release: 2009-06-04
Genre: Technology & Engineering
ISBN: 9781139442879

Molecular reaction dynamics is the study of chemical and physical transformations of matter at the molecular level. The understanding of how chemical reactions occur and how to control them is fundamental to chemists and interdisciplinary areas such as materials and nanoscience, rational drug design, environmental and astrochemistry. This book provides a thorough foundation to this area. The first half is introductory, detailing experimental techniques for initiating and probing reaction dynamics and the essential insights that have been gained. The second part explores key areas including photoselective chemistry, stereochemistry, chemical reactions in real time and chemical reaction dynamics in solutions and interfaces. Typical of the new challenges are molecular machines, enzyme action and molecular control. With problem sets included, this book is suitable for advanced undergraduate and graduate students, as well as being supplementary to chemical kinetics, physical chemistry, biophysics and materials science courses, and as a primer for practising scientists.