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Author: Alan Lewis
Publisher: Springer
ISBN: 3030006867
Category : Science
Languages : en
Pages : 167
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Book Description
This book sheds new light on the dynamical behaviour of electron spins in molecules containing two unpaired electrons (i.e. a radical pair). The quantum dynamics of these spins are made complicated by the interaction between the electrons and the many nuclear spins of the molecule; they are intractable using analytical techniques, and a naïve numerical diagonalization is not remotely possible using current computational resources. Hence, this book presents a new method for obtaining the exact quantum-mechanical dynamics of radical pairs with a modest number of nuclear spins. Readers will learn how a calculation that would take 13 years using conventional wavepacket propagation can now be done in 1 day, and will also discover a new semiclassical method for approximating the dynamics in the presence of many nuclear spins. The new methods covered in this book are shown to provide significant insights into three topical and diverse areas: charge recombination in molecular wires (which can be used in artificially mimicking photosynthesis), magnetoelectroluminescence in organic light-emitting diodes, and avian magnetoreception (how birds sense the Earth’s magnetic field in order to navigate).
Author: Alan Lewis
Publisher: Springer
ISBN: 3030006867
Category : Science
Languages : en
Pages : 167
Get Book Here
Book Description
This book sheds new light on the dynamical behaviour of electron spins in molecules containing two unpaired electrons (i.e. a radical pair). The quantum dynamics of these spins are made complicated by the interaction between the electrons and the many nuclear spins of the molecule; they are intractable using analytical techniques, and a naïve numerical diagonalization is not remotely possible using current computational resources. Hence, this book presents a new method for obtaining the exact quantum-mechanical dynamics of radical pairs with a modest number of nuclear spins. Readers will learn how a calculation that would take 13 years using conventional wavepacket propagation can now be done in 1 day, and will also discover a new semiclassical method for approximating the dynamics in the presence of many nuclear spins. The new methods covered in this book are shown to provide significant insights into three topical and diverse areas: charge recombination in molecular wires (which can be used in artificially mimicking photosynthesis), magnetoelectroluminescence in organic light-emitting diodes, and avian magnetoreception (how birds sense the Earth’s magnetic field in order to navigate).
Author: Alan Lewis
Publisher:
ISBN: 9783030006877
Category : Electrons
Languages : en
Pages :
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Book Description
This book sheds new light on the dynamical behaviour of electron spins in molecules containing two unpaired electrons (i.e. a radical pair). The quantum dynamics of these spins are made complicated by the interaction between the electrons and the many nuclear spins of the molecule; they are intractable using analytical techniques, and a naïve numerical diagonalization is not remotely possible using current computational resources. Hence, this book presents a new method for obtaining the exact quantum-mechanical dynamics of radical pairs with a modest number of nuclear spins. Readers will learn how a calculation that would take 13 years using conventional wavepacket propagation can now be done in 1 day, and will also discover a new semiclassical method for approximating the dynamics in the presence of many nuclear spins. The new methods covered in this book are shown to provide significant insights into three topical and diverse areas: charge recombination in molecular wires (which can be used in artificially mimicking photosynthesis), magnetoelectroluminescence in organic light-emitting diodes, and avian magnetoreception (how birds sense the Earth's magnetic field in order to navigate).
Author: Hisaharu Hayashi
Publisher: World Scientific
ISBN: 9789812384232
Category : Science
Languages : en
Pages : 272
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Book Description
Readership: Graduate students, researchers and industrialists in chemistry, physics and biology.
Author: Malcolm D. Forbes
Publisher: John Wiley & Sons
ISBN: 9780470584101
Category : Science
Languages : en
Pages : 300
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Book Description
Covers the most advanced computational and experimental methods for studying carbon-centered radical intermediates With its focus on the chemistry of carbon-centered radicals and radical cations, this book helps readers fully exploit the synthetic utility of these intermediates in order to prepare fine chemicals and pharmaceutical products. Moreover, it helps readers better understand their role in complex atmospheric reactions and biological systems. Thoroughly up to date, the book highlights the most advanced computational and experimental methods available for studying and using these critically important intermediates. Carbon-Centered Free Radicals and Radical Cations begins with a short history of the field of free radical chemistry, and then covers: A discussion of the relevant theory Mechanistic chemistry, with an emphasis on synthetic utility Molecular structure and mechanism, focusing on computational methods Spectroscopic investigations of radical structure and kinetics, including demonstrations of spin chemistry techniques such as CIDNP and magnetic field effects Free radical chemistry in macromolecules Each chapter, written by one or more leading experts, explains difficult concepts clearly and concisely, with references to facilitate further investigation of individual topics. The authors were selected in order to provide insight into a broad range of topics, including small molecule synthesis, polymer degradation, computational chemistry as well as highly detailed experimental work in the solid, liquid, and gaseous states. This volume is essential for students or researchers interested in building their understanding of the role of carbon-centered radical intermediates in complex systems and how they may be used to develop a broad range of useful products.
Author: Zeev Valy Vardeny
Publisher: World Scientific
ISBN: 9813230169
Category : Technology & Engineering
Languages : en
Pages : 1364
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Book Description
This reference work on Spin in Organics contains four volumes dedicated to spin injection, spin transport, spin pumping, organic magnetic field effect, and molecular spintronics. The field of Organic Spintronics has accelerated and matured in the last dozen years with the realization of an organic spin-valve (in 2004) and magneto-resistance and magneto-electroluminescence in organic optoelectronic devices (2006).The book series is comprehensive in that it summarizes all aspects of Organic Spintronics to date. The first two volumes deal with spin injection, spin transport, spin manipulation and spin pumping into organic semiconductors. The main device that is thoroughly discussed here is the organic spin-valve, where spinterface states at the interface between the organic semiconductor and the ferromagnetic (FM) electrode has been the focus of many chapters. An interesting emerging subject is the role of chirality in the organic layer of the device. A relatively new method of achieving spin aligned carriers in organic semiconductors is spin pumping, where magnons in the FM substrate generate spin aligned carriers in the organic layer at the FM/organic interface.The third volume deals mainly with magnetic field effect in organic devices. Several spin-mixture processes that lead to magnetic field effect in devices and films are thoroughly discussed, such as hyperfine interaction, direct spin-orbit coupling, indirect spin-orbit coupling via Δg, triplet-triplet annihilation, and thermal spin alignment. The similarity between the magnetic field effect obtained in optoelectronic devices based on organic semiconductors and the novel hybrid organic-inorganic semiconductors is also a subject of intense interest. The fourth volume deals with spin in molecular films and devices. It includes thorough discussion of spin exchange interaction that leads to organic ferromagnets, as well as manifestation of various spin interactions in thin molecular films and devices.
Author: Masoud Mohseni
Publisher: Cambridge University Press
ISBN: 1107010802
Category : Science
Languages : en
Pages : 421
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Book Description
Explores the role of quantum mechanics in biology for advanced undergraduate and graduate students in physics, biology and chemistry.
Author: Amit Agarwal
Publisher: Springer Science & Business
ISBN: 3319062727
Category : Science
Languages : en
Pages : 354
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Book Description
Amit Agarwal’s thesis reports a substantial contribution to the microscopic simulation of radiation chemical reactions. In his research Agarwal extends existing models to further understand scavenging, spin and relaxation effects. This research has advanced the development of both the Monte Carlo Random Flights and the Independent Reaction Times (IRT) simulation tools. Particular highlights are the extension of these tools to include both the spin-exchange interaction and spin relaxation, both of which are influential in radiolytic systems where many reactions are spin-controlled. In addition, the study has led to the discovery of a novel correlation of the scavenging rate with the recombination time in low permittivity solvents. This finding goes against existing assumptions underlying the theory of diffusion kinetics while still being accommodated in the IRT method which demonstrates the power of this unconventional approach. The work in this thesis can be applied to a wide number of fields including the nuclear industry, medicine, food treatment, polymer curing, the preparation of nano-colloids, power generation and waste disposal.
Author: Ernst Lippert
Publisher: Springer Science & Business Media
ISBN: 3642794076
Category : Science
Languages : en
Pages : 598
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Book Description
"How does a photon get into an atom?" This question - fundamental to quantum mechanics - puzzled leading scientists such as Schrödinger and Heisenberg and is still asked by students. James D. Macomber's book was the first to provide a didactic and unified approach to the answer, which has now been updated by way of recent experimental results and modern theoretical interpretations written by leading scientists. It provides an understanding for similarities among the spectroscopic methods available and is stimulating to read, reflecting the excitement of scientific research.
Author: Douglas C. Neckers
Publisher: John Wiley & Sons
ISBN: 0470133813
Category : Science
Languages : en
Pages : 378
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Book Description
Setting the pace for progress and innovation . . . ADVANCES IN PHOTOCHEMISTRY More than a simple survey of the current literature, Advances in Photochemistry offers critical evaluations written by internationally recognized experts. These pioneering scientists offer unique and varied points of view of the existing data. Their articles are challenging as well as provocative and are intended to stimulate discussion, promote further research, and encourage new developments in the field. In this volume Spectroscopy and Photochemistry of Polyatomic Alkaline Earth-Containing Molecules PETER F. BERNATH Photochemically Induced Dynamic Nuclear Polarization MARTIN GOEZ Photophysics of Gaseous Aromatic Molecules: Excess Vibrational Energy Dependence of Radiationless Processes EDWARD C. LIM Lanthanide Complexes of Encapsulating Ligands as Luminescent Devices NANDA SABBATINI, MASSIMO GUARDIGLI, AND ILSE MANET Advances in the Measurement of Correlation in Photoproduct Motion CHRISTOPHER G. MORGAN, MARCEL DRABBELS, AND ALEC M. WODTKE
Author: Seung Hwan Ko
Publisher: BoD – Books on Demand
ISBN: 9533072733
Category : Technology & Engineering
Languages : en
Pages : 336
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Book Description
This book contains a collection of latest research developments on Organic light emitting diodes (OLED). It is a promising new research area that has received a lot of attention in recent years. Here you will find interesting reports on cutting-edge science and technology related to materials, fabrication processes, and real device applications of OLEDs. I hope that the book will lead to systematization of OLED study, creation of new research field and further promotion of OLED technology for the bright future of our society.
