ISBN: 9783319907802 - classical and quantum molecular dynamics in nmr spectra (9 Ergebnisse)

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Buch. Zustand: Neu. Druck auf Anfrage Neuware - Printed after ordering - The book provides a detailed account of how condensed-phase molecular dynamics are reflected in the line shapes of NMR spectra. The theories establishing connections between random,time-dependent molecular processesand lineshape effects are exposed in depth. Special emphasis is placed on the theoretical aspects, involving in particular intermolecular processes in solution, and molecular symmetry issues. The Liouville super-operator formalism is briefly introduced and used wherever it is beneficial for the transparency ofpresentation. The proposed formal descriptions of the discussed problemsare sufficiently detailed to be implemented on a computer. Practical applications of the theory in solid- and liquid-phase studies are illustrated with appropriate experimental examples, exposing the potential ofthe lineshape method in elucidating molecular dynamicsNMR-observable molecular phenomena wherequantization of the spatial nuclear degrees of freedom is crucial are addressed in the last part of the book. As an introduction to this exciting research field,selected aspects of the quantum mechanics of isolated systems undergoing rotational tunnelling are reviewed, together with some basic information about quantum systems interacting with their condensed environment. The quantum theory of rate processes evidenced in the NMR lineshapes ofmolecular rotors is presented, and illustrated with appropriate experimentalexamples from both solid- and liquid-phase spectra. In this context, the everlasting problem of the quantum-to-classical transition isdiscussed at a quantitative level.The book will be suitable for graduate students and new and practising researchers using NMR techniques.…

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Zustand: New. 1st ed. 2018 edition NO-PA16APR2015-KAP.

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Buch. Zustand: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The book provides a detailed account of how condensed-phase molecular dynamics are reflected in the line shapes of NMR spectra. The theories establishing connections between random,time-dependent molecular processesand lineshape effects are exposed in depth. Special emphasis is placed on the theoretical aspects, involving in particular intermolecular processes in solution, and molecular symmetry issues. The Liouville super-operator formalism is briefly introduced and used wherever it is beneficial for the transparency ofpresentation. The proposed formal descriptions of the discussed problemsare sufficiently detailed to be implemented on a computer. Practical applications of the theory in solid- and liquid-phase studies are illustrated with appropriate experimental examples, exposing the potential ofthe lineshape method in elucidating molecular dynamicsNMR-observable molecular phenomena wherequantization of the spatial nuclear degrees of freedom is crucial are addressed in the last part of the book. As an introduction to this exciting research field,selected aspects of the quantum mechanics of isolated systems undergoing rotational tunnelling are reviewed, together with some basic information about quantum systems interacting with their condensed environment. The quantum theory of rate processes evidenced in the NMR lineshapes ofmolecular rotors is presented, and illustrated with appropriate experimentalexamples from both solid- and liquid-phase spectra. In this context, the everlasting problem of the quantum-to-classical transition isdiscussed at a quantitative level.The book will be suitable for graduate students and new and practising researchers using NMR techniques. 416 pp. Englisch.…

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Zustand: New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. Offers a complete description of the study of condensed-phase molecular dynamics using NMR spectroscopy, covering theoretical principles and practical applicationDescribes the theories of nuclear spin relaxation and NMR lineshapes in detail.…

Sprache: Englisch
Verlag: Springer International Publishing, Springer International Publishing Jun 2018, 2018
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Buch. Zustand: Neu. This item is printed on demand - Print on Demand Titel. Neuware -The book provides a detailed account of how condensed-phase molecular dynamics are reflected in the line shapes of NMR spectra. The theories establishing connections between random, time-dependent molecular processes and lineshape effects are exposed in depth. Special emphasis is placed on the theoretical aspects, involving in particular intermolecular processes in solution, and molecular symmetry issues. The Liouville super-operator formalism is briefly introduced and used wherever it is beneficial for the transparency of presentation. The proposed formal descriptions of the discussed problems are sufficiently detailed to be implemented on a computer. Practical applications of the theory in solid- and liquid-phase studies are illustrated with appropriate experimental examples, exposing the potential of the lineshape method in elucidating molecular dynamicsNMR-observable molecular phenomena where quantization of the spatial nuclear degrees of freedom is crucial are addressed in the last part of the book. As an introduction to this exciting research field, selected aspects of the quantum mechanics of isolated systems undergoing rotational tunnelling are reviewed, together with some basic information about quantum systems interacting with their condensed environment. The quantum theory of rate processes evidenced in the NMR lineshapes of molecular rotors is presented, and illustrated with appropriate experimental examples from both solid- and liquid-phase spectra. In this context, the everlasting problem of the quantum-to-classical transition is discussed at a quantitative level.The book will be suitable for graduate students and new and practising researchers using NMR techniques.Springer Verlag GmbH, Tiergartenstr. 17, 69121 Heidelberg 416 pp. Englisch.…

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