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Author : Raffaele Borrelli
Publisher :
ISBN 13 :
Total Pages : 116 pages
Book Rating : 4.:/5 (14 download)
Download or read book Quantum Dynamics of Ultrafast Chemical Processes written by Raffaele Borrelli and published by . This book was released on 2003 with total page 116 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : Matthieu Sala
Publisher : Springer
ISBN 13 : 3319289799
Total Pages : 198 pages
Book Rating : 4.3/5 (192 download)
Download or read book Quantum Dynamics and Laser Control for Photochemistry written by Matthieu Sala and published by Springer. This book was released on 2016-01-23 with total page 198 pages. Available in PDF, EPUB and Kindle. Book excerpt: The central subject of this thesis is the theoretical description of ultrafast dynamical processes in molecular systems of chemical interest and their control by laser pulses. This work encompasses different cutting-edge methods in quantum chemistry, quantum dynamics and for the rigorous description of the interaction of light and matter at the molecular level. It provides a general quantum mechanical framework for the description of chemical processes guided by laser pulses, in particular near conical intersections, i.e. geometries where the nuclear and electronic motions couple and the molecule undergoes non-adiabatic (or non-Born-Oppenheimer) dynamics. In close collaboration with experimentalists, the author succeeds in making a decisive step to link and to apply quantum physics to chemistry by transferring state of the art techniques and concepts developed in physics to chemistry, such as “light dressed atoms and molecules” and “adiabatic Floquet theory”. He applies these techniques in three prototypic model systems (aniline, pyrazine and NHD2) using high-level electronic structure calculations. Readers will enjoy the comprehensive and accessible introduction to the topic and methodology, as well as the clear structure of the thesis.
Author : Roberto Marquardt
Publisher : Elsevier
ISBN 13 : 0128172355
Total Pages : 376 pages
Book Rating : 4.1/5 (281 download)
Download or read book Molecular Spectroscopy and Quantum Dynamics written by Roberto Marquardt and published by Elsevier. This book was released on 2020-09-18 with total page 376 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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 quantum dynamics and spectroscopy of electronic and nuclear motion Presents the most recent developments in the detection and interpretation of ultra-fast phenomena Includes a discussion of the importance of these phenomena for the understanding of chemical reaction dynamics and kinetics in relation to molecular spectra and structure
Author : Ahmed H. Zewail
Publisher : World Scientific
ISBN 13 : 9789810217365
Total Pages : 622 pages
Book Rating : 4.2/5 (173 download)
Download or read book Femtochemistry written by Ahmed H. Zewail and published by World Scientific. This book was released on 1994 with total page 622 pages. Available in PDF, EPUB and Kindle. Book excerpt: These two volumes on Femtochemistry present a timely contribution to a field central to the understanding of the dynamics of the chemical bond. This century has witnessed great strides in time and space resolutions, down to the atomic scale, providing chemists, biologists and physicists with unprecedented opportunities for seeing microscopic structures and dynamics. Femtochemistry is concerned with the time resolution of the most elementary motions of atoms during chemical change -- bond breaking and bond making -- on the femtosecond (10-15 second) time scale. This atomic scale of time resolution has now reached the ultimate for the chemical bond and as Lord George Porter puts it, chemists are near the end of the race against time. These two volumes cover the general concepts, techniques and applications of femtochemistry.Professor Ahmed Zewail, who has made the pioneering contributions in this field, has from over 250 publications selected the articles for this anthology. These volumes begin with a commentary and a historical chronology of the milestones. He then presents a broad perspective of the current state of knowledge in femtochemistry by researchers around the world and discusses possible new directions. In the words of a colleague, "it is a must on the reading-list for all of my students ... all readers will find this to be an informative and valuable overview."The introductory articles in Volume I provide reviews for both the non-experts as well as for experts in the field. This is followed by papers on the basic concepts. For applications, elementary reactions are studied first and then complex reactions. Volume I is complete with studies of solvation dynamics, non-reactive systems, ultrafast electron diffraction and the control of chemical reactions.Volume II continues with reaction rates, the concept of elementary intramolecular vibrational-energy redistribution (IVR) and the phenomena of rotational coherence which has become a powerful tool for the determination of molecular structure via time resolution. The second volume ends with an extensive list of references, according to topics, based on work by Professor Zewail and his group at Caltech.These collected works by Professor Zewail will certainly be indispensable to both experts and beginners in the field. The author is known for his clarity and for his creative and systematic contributions. These volumes will be of interest and should prove useful to chemists, biologists and physicists. As noted by Professor J Manz (Berlin) and Professor A W Castleman, Jr. (Penn State): femtochemistry is yielding exciting new discoveries from analysis to control of chemical reactions, with applications in many domains of chemistry and related fields, e.g., physical, organic and inorganic chemistry, surface science, molecular biology, ... etc.
Author : Fabien Gatti
Publisher : Springer Science & Business Media
ISBN 13 : 3642452906
Total Pages : 281 pages
Book Rating : 4.6/5 (424 download)
Download or read book Molecular Quantum Dynamics written by Fabien Gatti and published by Springer Science & Business Media. This book was released on 2014-04-09 with total page 281 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Author : Majed Chergui
Publisher : World Scientific
ISBN 13 : 981454826X
Total Pages : 718 pages
Book Rating : 4.8/5 (145 download)
Download or read book Femtochemistry: Ultrafast Chemical And Physical Processes In Molecular Systems written by Majed Chergui and published by World Scientific. This book was released on 1996-04-30 with total page 718 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book highlights the latest experimental and theoretical developments in the field of femtochemistry, with papers describing the physics and chemistry of ultrafast processes in small molecules, complex molecular systems, clusters, biological systems, solids, matrices, liquids and at surfaces and interfaces. The recent developments in frequency-domain studies of femtodynamics are also presented. In addition, the latest achievements in femtosecond control of chemical reactions are presented, together with the newest techniques in real-time probing of reactions such as ultrafast x-ray or electron diffraction. The papers are rich in references giving a clearcut state-of-the-art of the topics being discussed. The book should be a valuable tool to all persons in the field and to young scientists.Contributors include: A H Zewail, J Jortner, V S Letokhov, J Manz, R S Berry, C Wittig, K B Eisenthal, A W Castleman Jr., J T Hynes, W H Gadzuk, R Kosloff, S Mukamel, K R Wilson; G Fleming, D Wiersma, K Yoshihara, V Sundström, A Apkarian, N Scherer, A Myers, R Schinke, J R Huber, R B Gerber, G Gerber and P M Champion.
Author : Joel Yuen-Zhou
Publisher : Iop Expanding Physics
ISBN 13 : 9780750310635
Total Pages : 0 pages
Book Rating : 4.3/5 (16 download)
Download or read book Ultrafast Spectroscopy written by Joel Yuen-Zhou and published by Iop Expanding Physics. This book was released on 2014 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: The goal of this book is to provide a simple and conceptually intuitive introduction to nonlinear spectroscopy via the formalism of quantum processes and wavepacket dynamics.
Author : David A. Micha
Publisher : Springer Science & Business Media
ISBN 13 : 3540344608
Total Pages : 424 pages
Book Rating : 4.5/5 (43 download)
Download or read book Quantum Dynamics of Complex Molecular Systems written by David A. Micha and published by Springer Science & Business Media. This book was released on 2006-11-22 with total page 424 pages. Available in PDF, EPUB and Kindle. Book excerpt: Quantum phenomena are ubiquitous in complex molecular systems - as revealed by many experimental observations based upon ultrafast spectroscopic techniques - and yet remain a challenge for theoretical analysis. The present volume, based on a May 2005 workshop, examines and reviews the state-of-the-art in the development of new theoretical and computational methods to interpret the observed phenomena. Emphasis is on complex molecular processes involving surfaces, clusters, solute-solvent systems, materials, and biological systems. The research summarized in this book shows that much can be done to explain phenomena in systems excited by light or through atomic interactions. It demonstrates how to tackle the multidimensional dynamics arising from the atomic structure of a complex system, and addresses phenomena in condensed phases as well as phenomena at surfaces. The chapters on new methodological developments cover both phenomena in isolated systems, and phenomena which involve the statistical effects of an environment, such as fluctuations and dissipation. The methodology part explores new rigorous ways to formulate mixed quantum-classical dynamics in many dimensions, along with new ways to solve a many-atom Schroedinger equation, or the Liouville-von Neumann equation for the density operator, using trajectories and ideas related to hydrodynamics. Part I treats applications to complex molecular systems, and Part II covers new theoretical and computational methods
Author : Leticia González
Publisher : John Wiley & Sons
ISBN 13 : 1119417759
Total Pages : 52 pages
Book Rating : 4.1/5 (194 download)
Download or read book Quantum Chemistry and Dynamics of Excited States written by Leticia González and published by John Wiley & Sons. This book was released on 2021-02-01 with total page 52 pages. Available in PDF, EPUB and Kindle. Book excerpt: An introduction to the rapidly evolving methodology of electronic excited states For academic researchers, postdocs, graduate and undergraduate students, Quantum Chemistry and Dynamics of Excited States: Methods and Applications reports the most updated and accurate theoretical techniques to treat electronic excited states. From methods to deal with stationary calculations through time-dependent simulations of molecular systems, this book serves as a guide for beginners in the field and knowledge seekers alike. Taking into account the most recent theory developments and representative applications, it also covers the often-overlooked gap between theoretical and computational chemistry. An excellent reference for both researchers and students, Excited States provides essential knowledge on quantum chemistry, an in-depth overview of the latest developments, and theoretical techniques around the properties and nonadiabatic dynamics of chemical systems. Readers will learn: ● Essential theoretical techniques to describe the properties and dynamics of chemical systems ● Electronic Structure methods for stationary calculations ● Methods for electronic excited states from both a quantum chemical and time-dependent point of view ● A breakdown of the most recent developments in the past 30 years For those searching for a better understanding of excited states as they relate to chemistry, biochemistry, industrial chemistry, and beyond, Quantum Chemistry and Dynamics of Excited States provides a solid education in the necessary foundations and important theories of excited states in photochemistry and ultrafast phenomena.
Author : Stefan Haacke
Publisher : CRC Press
ISBN 13 : 9814745340
Total Pages : 529 pages
Book Rating : 4.8/5 (147 download)
Download or read book Ultrafast Dynamics at the Nanoscale written by Stefan Haacke and published by CRC Press. This book was released on 2017-01-06 with total page 529 pages. Available in PDF, EPUB and Kindle. Book excerpt: Ultrafast Dynamics at the Nanoscale provides a combined experimental and theoretical insight into the molecular-level investigation of light-induced quantum processes in biological systems and nanostructured (bio)assemblies. Topics include DNA photostability and repair, photoactive proteins, biological and artificial light-harvesting systems, plasmonic nanostructures, and organic photovoltaic materials, whose common denominator is the key importance of ultrafast quantum effects at the border between the molecular scale and the nanoscale. The functionality and control of these systems have been under intense investigation in recent years in view of developing a detailed understanding of ultrafast nanoscale energy and charge transfer, as well as fostering novel technologies based on sustainable energy resources. Both experiment and theory have made big strides toward meeting the challenge of these truly complex systems. This book, thus, introduces the reader to cutting-edge developments in ultrafast nonlinear optical spectroscopies and the quantum dynamical simulation of the observed dynamics, including direct simulations of two-dimensional optical experiments. Taken together, these techniques attempt to elucidate whether the quantum coherent nature of ultrafast events enhances the efficiency of the relevant processes and where the quantum–classical boundary sets in, in these high-dimensional biological and material systems. The chapters contain well-illustrated accounts of the authors’ research work, including didactic introductory material, and address a multidisciplinary audience from chemistry, physics, biology, and materials sciences. The book is, therefore, a must-have for graduate- and postgraduate-level researchers who wish to learn about molecular nanoscience from a combined spectroscopic and theoretical viewpoint.
Author : T. Elsaesser
Publisher : Springer Science & Business Media
ISBN 13 : 3642565468
Total Pages : 709 pages
Book Rating : 4.6/5 (425 download)
Download or read book Ultrafast Phenomena XII written by T. Elsaesser and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 709 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents the latest advances in ultrafast science, including ultrafast laser and measurement technology, and studies of ultrafast phenomena. It summarizes the results presented at the 12th Ultrafast Phenomena Conference and reviews the state of the art of this important and rapidly advancing field.
Author : Rebeca de Nalda
Publisher : Springer Science & Business Media
ISBN 13 : 331902051X
Total Pages : 298 pages
Book Rating : 4.3/5 (19 download)
Download or read book Ultrafast Phenomena in Molecular Sciences written by Rebeca de Nalda and published by Springer Science & Business Media. This book was released on 2013-10-22 with total page 298 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents the latest developments in Femtosecond Chemistry and Physics for the study of ultrafast photo-induced molecular processes. Molecular systems, from the simplest H2 molecule to polymers or biological macromolecules, constitute central objects of interest for Physics, Chemistry and Biology, and despite the broad range of phenomena that they exhibit, they share some common behaviors. One of the most significant of those is that many of the processes involving chemical transformation (nuclear reorganization, bond breaking, bond making) take place in an extraordinarily short time, in or around the femtosecond temporal scale (1 fs = 10-15 s). A number of experimental approaches - very particularly the developments in the generation and manipulation of ultrashort laser pulses - coupled with theoretical progress, provide the ultrafast scientist with powerful tools to understand matter and its interaction with light, at this spatial and temporal scale. This book is an attempt to reunite some of the state-of-the-art research that is being carried out in the field of ultrafast molecular science, from theoretical developments, through new phenomena induced by intense laser fields, to the latest techniques applied to the study of molecular dynamics.
Author : Sarah Elizabeth Morgan
Publisher : Springer
ISBN 13 : 3319633996
Total Pages : 121 pages
Book Rating : 4.3/5 (196 download)
Download or read book Ultrafast Quantum Effects and Vibrational Dynamics in Organic and Biological Systems written by Sarah Elizabeth Morgan and published by Springer. This book was released on 2017-08-01 with total page 121 pages. Available in PDF, EPUB and Kindle. Book excerpt: This thesis focuses on theoretical analysis of the sophisticated ultrafast optical experiments that probe the crucial first few picoseconds of quantum light harvesting, making an important contribution to quantum biology, an exciting new field at the intersection of condensed matter, physical chemistry and biology. It provides new insights into the role of vibrational dynamics during singlet fission of organic pentacene thin films, and targeting the importance of vibrational dynamics in the design of nanoscale organic light harvesting devices, it also develops a new wavelet analysis technique to probe vibronic dynamics in time-resolved nonlinear optical experiments. Lastly, the thesis explores the theory of how non-linear “breather” vibrations are excited and propagate in the disordered nanostructures of photosynthetic proteins.
Author : J.D. Simon
Publisher : Springer Science & Business Media
ISBN 13 : 9401109168
Total Pages : 388 pages
Book Rating : 4.4/5 (11 download)
Download or read book Ultrafast Dynamics of Chemical Systems written by J.D. Simon and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 388 pages. Available in PDF, EPUB and Kindle. Book excerpt: The last decade has witnessed significant advances in the ability to generate short light pulses throughout the optical spectrum. These developments have had a tremendous impact on the field of chemical dynamics. Fundamental questions concerning chemical reactions, once thought to be unaddressable, are now easily studied in real-time experiments. Ultrafast spectroscopies are currently being used to study a variety of fundamental chemical phenomena. This book focuses on some of the experimental and associated theoretical studies of reactions in clusters, liquid and solid media. Many of the advances in our understanding of the fundamental details of chemical reactivity result from the interplay of experiment and theory. This theme is present in many of the chapters, indicating the pervasiveness of a combined approach for eludicating molecular models of chemical reactions. With parallel developments in computer simulation, complex chemical sys tems are being studied at a molecular level. The discussions presented in this book recount many areas at the forefront of "ultrafast chemistry". They serve the purpose of both bringing the expert up to date with the work being done in many laboratories as well as introducing those not directly involved in this field to the diverse set of problems that can be studied. I hope that this book conveys the excitement that both I and the other authors in this volume feel about the field of ultrafast chemistry. John D. Simon 1993 1.D. Simon (ed.), Ultrafast Dynamics of Chemical Systems, vii.
Author : Julien Eng
Publisher :
ISBN 13 :
Total Pages : 0 pages
Book Rating : 4.:/5 (945 download)
Download or read book Dynamics of Ultrafast Processes in Excited States of Organic and Inorganic Compounds written by Julien Eng and published by . This book was released on 2015 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: This thesis can be divided in two parts.In the first one, we have studied the photoisomerization process in several systems. An electronic structure analysis mixed with a preliminary semi-classical dynamics investigation has been applied to a minimal model of the retinal chromophore in order to select the most important degrees of freedom involved in the process. The goal of this is to build diabatic potential energy surfaces in order to conduct quantum dynamics simulations. A semi-classical approach has also been applied to a molecular motor model to study the origin of the unidirectionality of its rotary motion. Finally, an electronic structure of a rhenium complex with a retinal-like ligand has been performed to study the effect of the coordination to a metallic atom on the spectroscopy of the retinal ligand. In the second part, we have investigated the intersystem crossings in a rhenium complex. In order to bring an explanation to an experimentally observed conterintuitive behavior of this complex, we have developed a model Hamiltonian that includes both interstate vibronic coupling and spin-orbit coupling. This Hamiltonian has been tested on the said complex and, in complement to an electronic structure study, allowed us to formulate a decay mechanism different from the one proposed based on experiments.
Author : Guo-ping Zhang
Publisher : CRC Press
ISBN 13 : 1498764290
Total Pages : 300 pages
Book Rating : 4.4/5 (987 download)
Download or read book Introduction to Ultrafast Phenomena written by Guo-ping Zhang and published by CRC Press. This book was released on 2020-12-08 with total page 300 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book, the first of this kind, provides a comprehensive introduction to ultrafast phenomena, covering the fundamentals of ultrafast spin and charge dynamics, femtosecond magnetism, all-optical spin switching, and high-harmonic generation. It covers the experimental tools, including ultrafast pump-probe experiments, and theoretical methods including quantum chemistry and density functional theory, both time-independent and time-dependent. The authors explain in clear language how an ultrafast laser pulse is generated experimentally, how it can induce rapid responses in electrons and spins in molecules, nanostructures and solids (magnetic materials and superconductors), and how it can create high-harmonic generation from atoms and solids on the attosecond timescale. They also show how this field is driving the next generation of magnetic storage devices through femtomagnetism, all-optical spin switching in ferrimagnets and beyond, magnetic logic in magnetic molecules, and ultrafast intense light sources, incorporating numerous computer programs, examples, and problems throughout, to show how the beautiful research can be done behind the scene. Key features: · Provides a clear introduction to modern ultrafast phenomena and their applications in physics, chemistry, materials sciences, and engineering. · Presents in detail how high-harmonic generation occurs in atoms and solids. · Explains ultrafast demagnetization and spin switching, a new frontier for development of faster magnetic storage devices. · Includes numerous worked-out examples and problems in each chapter, with real research codes in density functional theory and quantum chemical calculations provided in the chapters and in the Appendices. This book is intended for undergraduate and graduate students, researchers in physics, chemistry, biology, materials sciences, and engineering.
Author : Paul Corkum
Publisher : Springer Science & Business Media
ISBN 13 : 3540687793
Total Pages : 853 pages
Book Rating : 4.5/5 (46 download)
Download or read book Ultrafast Phenomena XV written by Paul Corkum and published by Springer Science & Business Media. This book was released on 2007-07-10 with total page 853 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume is a collection of papers presented at the Fifteenth International Conference on Ultrafast Phenomena held at the Asilomar Conference Grounds, Pacifc Grove, CA, USA, from July 31 – August 4, 2006. The Ultrafast P- nomena conferences are held every two years and provide a forum for disc- sion of the latest results in ultrafast optics and their applications in science and engineering. These meetings bring together researchers spanning several felds of science and engineering to discuss and debate the latest advances in ult- fast science. This unique forum provides a conduit for the greater dissemi- tion of the latest advances using ultrashort coherent pulses of light. More than 280 papers were presented. Signifcant progress in creating ever shorter pulses of light was reported in the attosecond range, with new applications in high harmonic generation and frequency comb metrology. Multidimensional sp- troscopy is rapidly evolving to provide new insights into quantum coherence and interactions in complex systems. Improvements in time resolved electron and x-ray diffraction provide better atomic scale perspectives on structural dynamics. These examples are but a small subset of the collected works ga- ered in this volume, which provides a valuable synopsis of the recent advances and impact of ultrafast technology in illuminating fundamental processes in physics, chemistry, and biology. There were 323 attendees at the meeting, more than one third of which were graduate and postdoctoral students. Increased s- dent attendance energized the proceedings.
