Molecular Excitation Dynamics and Relaxation

Molecular Excitation Dynamics and Relaxation

Author: Leonas Valkunas

Publisher: John Wiley & Sons

Published: 2013-10-04

Total Pages: 414

ISBN-13: 3527653678

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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.


Relaxation Processes in Molecular Excited States

Relaxation Processes in Molecular Excited States

Author: J. Fünfschilling

Publisher: Springer Science & Business Media

Published: 2012-12-06

Total Pages: 282

ISBN-13: 9400908636

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Relaxation phenomena of excited molecular states are abundant in all nature. They mediate such key processes as photochemical reactions or even the pathways of ordinary chemical reactions. However, for a long time the main research in electronic relaxation processes was concerned with anorganic solids, in part because of their great technological importance (photography, semiconductors ... ) in part also because these compounds were the "workhorses" of the solid state physicists. In the last 30 years, there was a steadily increasing interest in organic molecular systems, first in molecular crystals and later in all forms of molecular solids (glasses, polymers, membranes, ... ). The present volume combines papers on quite different types of relaxation phenomena: the type of solid studied, the electronic states involved, the physical processes responsible for the relaxations are all different. Nevertheless, after reading this book, a more clear and complete picture of the phenomenon "relaxa tion" emerges that proves that this volume is more than just a collection of individual articles. The volume starts with the paper "Spin-lattice and spin-spin relaxation in photo-excited triplet states in molecular crystals" by Jan Schmidt. Even in these seemingly simple systems of isolated guest molecules in a single crystal host, the relaxation phenomena are quite involved and a very thorough investigation is necessary to find the key relaxation processes. The end of the article provides a bridge to the following paper: it treats interactions of two molecules (dimers), where resonant interactions become important and lead to new, characteristic relaxation processes.


Charge and Energy Transfer Dynamics in Molecular Systems

Charge and Energy Transfer Dynamics in Molecular Systems

Author: Volkhard May

Publisher: John Wiley & Sons

Published: 2011-04-27

Total Pages: 600

ISBN-13: 3527633812

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This 3rd edition has been expanded and updated to account for recent developments, while new illustrative examples as well as an enlarged reference list have also been added. It naturally retains the successful concept of its predecessors in presenting a unified perspective on molecular charge and energy transfer processes, thus bridging the regimes of coherent and dissipative dynamics, and establishing a connection between classic rate theories and modern treatments of ultrafast phenomena. Among the new topics are: - Time-dependent density functional theory - Heterogeneous electron transfer, e.g. between molecules and metal or semiconductor surfaces - Current flows through a single molecule. While serving as an introduction for graduate students and researchers, this is equally must-have reading for theoreticians and experimentalists, as well as an aid to interpreting experimental data and accessing the original literature.


Radiationless Transitions

Radiationless Transitions

Author: Sheng Lin

Publisher: Elsevier

Published: 2012-12-02

Total Pages: 440

ISBN-13: 0323150276

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Radiationless Transitions is a critical discussion of research studies on the theory and experiments in radiationless transitions. This book is composed of nine chapters, and begins with discussions on the theory and experiment of photophysical processes of single vibronic levels and/or single rovibronic levels. The subsequent chapters deal with the spectroscopic investigations of intramolecular vibrational relaxation; the dynamics of molecular excitation by light; and the photophysical processes of small molecules in condensed phase. The discussions then shift to the high pressure effects on molecular luminescence and the internal conversion involving localized excitations, presenting one qualitative and one quantitative example, as well as the intersystem crossing with localized excitations. A chapter explores the energy transfer processes that occur after a molecule in solution is excited by light, with an emphasis on solid solutions in which the large amplitude molecular motion is largely quenched. This chapter also looks into the liquid solutions in which the molecules can translate and rotate under the influence of fluctuating forces from the liquid. The concluding chapter focuses on ultrafast processes. Researchers in the fields of physics, chemistry, and biology will benefit from this book.


Vibrational Dynamics Of Molecules

Vibrational Dynamics Of Molecules

Author: Joel M Bowman

Publisher: World Scientific

Published: 2022-06-14

Total Pages: 603

ISBN-13: 9811237921

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Vibrational Dynamics of Molecules represents the definitive concise text on the cutting-edge field of vibrational molecular chemistry. The chapter contributors are a Who's Who of world leaders in the field. The editor, Joel Bowman, is widely considered as one of the founding fathers of theoretical reaction dynamics. The included topics span the field, from fundamental theory such as collocation methods and vibrational CI methods, to interesting applications such as astrochemistry, supramolecular systems and virtual computational spectroscopy. This is a useful reference for theoretical chemists, spectroscopists, physicists, undergraduate and graduate students, lecturers and software developers.


Hydrogen Bonding and Transfer in the Excited State

Hydrogen Bonding and Transfer in the Excited State

Author: Ke-Li Han

Publisher: John Wiley & Sons

Published: 2011-03-16

Total Pages: 1229

ISBN-13: 1119972922

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This book gives an extensive description of the state-of-the-art in research on excited-state hydrogen bonding and hydrogen transfer in recent years. Initial chapters present both the experimental and theoretical investigations on the excited-state hydrogen bonding structures and dynamics of many organic and biological chromophores. Following this, several chapters describe the influences of the excited-state hydrogen bonding on various photophysical processes and photochemical reactions, for example: hydrogen bonding effects on fluorescence emission behaviors and photoisomerization; the role of hydrogen bonding in photosynthetic water splitting; photoinduced electron transfer and solvation dynamics in room temperature ionic liquids; and hydrogen bonding barrier crossing dynamics at bio-mimicking surfaces. Finally, the book examines experimental and theoretical studies on the nature and control of excited-state hydrogen transfer in various systems. Hydrogen Bonding and Transfer in the Excited State is an essential overview of this increasingly important field of study, surveying the entire field over 2 volumes, 40 chapters and 1200 pages. It will find a place on the bookshelves of researchers in photochemistry, photobiology, photophysics, physical chemistry and chemical physics.


Molecular Dynamics and Spectroscopy by Stimulated Emission Pumping

Molecular Dynamics and Spectroscopy by Stimulated Emission Pumping

Author: Hai-Lung Dai

Publisher: World Scientific

Published: 1995

Total Pages: 1154

ISBN-13: 9789810217495

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Since the first stimulated emission pumping (SEP) experiments more than a decade ago, this technique has proven powerful for studying vibrationally excited molecules. SEP is now widely used by increasing numbers of research groups to investigate fundamental problems in spectroscopy, intramolecular dynamics, intermolecular interactions, and even reactions. SEP provides rotationally pre-selected spectra of vibrationally highly excited molecules undergoing large amplitude motions. A unique feature of SEP is the ability to access systematically a wide variety of extreme excitations localized in various parts of a molecule, and to prepare populations in specific, high vibrational levels. SEP has made it possible to ask and answer specific questions about intramolecular vibrational redistribution and the role of vibrational excitation in chemical reactions.