NMR Spectroscopy and Molecular Dynamics - An Outlook
Chapter
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Abstract
Two main sorts of molecular dynamics, the tumbling motion in liquids and the rate processes in the state of dynamic equilibrium, are considered in the context of their impact on the behavior of the nuclear spins. Basic principles of nuclear spin relaxation are outlined. A formal justification of the Bloch equations is described. The manifestations of the rate processes in the resonance lineshapes are considered in the framework of the vector model of NMR.
References
- 1.N. Bloembergen, E.M. Purcell, R.V. Pound, Phys. Rev. 73, 679 (1948)ADSCrossRefGoogle Scholar
- 2.A.G. Redfield, IBM J. Res. Dev. 1, 19 (1957)CrossRefGoogle Scholar
- 3.R.K. Wangsness, F. Bloch, Phys. Rev. 89, 728 (1953)ADSCrossRefGoogle Scholar
- 4.F. Bloch, Phys. Rev. 102, 104 (1956)ADSCrossRefGoogle Scholar
- 5.H.-P. Breuer, F. Petruccione, The Theory of Open Quantum Systems (Oxford University Press, New York, 2007). Ch. 3CrossRefGoogle Scholar
- 6.A. Abragam, Principles of Nuclear Magnetism (Oxford, Clarendon Press, 1961). Ch. 8Google Scholar
- 7.P.N. Argyres, P.L. Kelley, Phys. Rev. 134, A98 (1964)ADSCrossRefGoogle Scholar
- 8.H.W. Spiess, Dynamic NMR spectroscopy, in NMR Basic Principles and Progress, vol. 15, ed. by P. Diehl, E. Fluck, R. Kosfeld (Springer, Berlin, 1978)Google Scholar
- 9.A.G. Redfield, Introductory Essays, in NMR Basic Principles and Progress, vol. 13, ed. by M.M. Pintar (Springer, Berlin, 1976)Google Scholar
- 10.D.H. Jones, J.A. Labinger, D.P. Weitekamp, J. Am. Chem. Soc. 111, 3087 (1989)CrossRefGoogle Scholar
- 11.L.G. Werbelow, J. Chem. Phys. 70, 5381 (1979)ADSCrossRefGoogle Scholar
- 12.J. Zhu, E. Ye, V. Terskikh, G. Wu, J. Phys. Chem. Lett. 2, 1020 (2011)CrossRefGoogle Scholar
- 13.J. Kowalewski, L. Mäler, Nuclear Spin Relaxation in Liquids: Theory, Experiments, and Applications (Taylor and Francis, New York, 2006)CrossRefGoogle Scholar
- 14.P.S. Hubbard, Phys. Rev. 131, 1155 (1963)ADSCrossRefGoogle Scholar
- 15.(a) N.C. Pyper, Mol. Phys. 20, 449 (1971); (b) N.C. Pyper, Mol. Phys. 21, 961 (1971)Google Scholar
- 16.P.E. Balonga, J. Magn. Reson. 59, 50 (1984)ADSGoogle Scholar
- 17.S. Szymański, G. Binsch, J. Magn. Reeson. 81, 104 (1989)ADSGoogle Scholar
- 18.J. Kowalewski, L. Mäler, Nuclear Spin Relaxation in Liquids: Theory, Experiments, and Applications (Taylor and Francis, New York, 2006). Ch. 15Google Scholar
- 19.I. Solomon, Phys. Rev. 99, 559 (1955)ADSCrossRefGoogle Scholar
- 20.(a) A.A. Bothner-by, R.L. Stephens, J. Lee, T.D. Warren, R.W. Jeanloz, J. Am. Chem. Soc. 106, 811 (1984) (b) A. Bax, D.G. Davis, J. Magn. Reson. 63, 207 (1985)Google Scholar
- 21.A. Allerhand, E. Thiele, J. Chem. Phys. 45, 902 (1966)ADSCrossRefGoogle Scholar
- 22.E. Bodewig, Matrix Calculus, 2nd edn. (North-Holland Publishing Company, Amsterdam, 1959)zbMATHGoogle Scholar
- 23.Z.S. Szalay, J. Rohonczy, J. Magn. Reson. 197, 48 (2009)ADSCrossRefGoogle Scholar
- 24.Z.S. Szalay, J. Rohonczy, Prog. Nucl. Magn. Reson. Spectrosc. 56, 198 (2010)CrossRefGoogle Scholar
- 25.Z.S. Szalay, J. Rohonczy, Annu. Rep. NMR Spectrosc. 73, 175 (2011)CrossRefGoogle Scholar
- 26.A. Krupowicz, PhD. Thesis, Warsaw University of Technology (1977)Google Scholar
- 27.C.P. Slichter, in Principles of Magnetic Resonance, vol. 1, 2nd edn., Solid-State Sciences, ed. by M. Cardoua, P. Fulde, H.J. Queisser (Springer, Berlin, 1978), p. 372Google Scholar
- 28.E.L. Hahn, D.E. Maxwell, Phys. Rev. 88, 1070 (1952)ADSCrossRefGoogle Scholar
- 29.H.M. McConnell, J. Chem. Phys. 28, 430 (1958)ADSCrossRefGoogle Scholar
- 30.R. Kubo, Nuovo Cimento, Suppl. 6, 1063 (1957)ADSCrossRefGoogle Scholar
- 31.R.A. Sack, Mol. Phys. 1, 163 (1958)ADSCrossRefGoogle Scholar
- 32.M. Gromova, O. Jarjayes, S. Hamman, R. Nardin, C. Béguin, R. Willem, Eur. J. Inorg. Chem. 2000, 545 (2000)CrossRefGoogle Scholar
- 33.C. Ye, S. Ding, C.A. MCDowell, Ann. Rep. NMR Spectrosc. 42, 60 (2000)CrossRefGoogle Scholar
- 34.P. Hodgkinson, in NMR Crystallography, ed. by R.K. Harris, R.E. Wasylishen, M.J. Duer (Wiley, Chichester, 2009). Ch. 25Google Scholar
- 35.A.J. Vega, Z. Luz, J. Chem. Phys. 86, 1803 (1987)ADSCrossRefGoogle Scholar
- 36.S. Schlick, Z. Luz, R. Poupko, H. Zimmermann, J. Am. Chem. Soc. 114, 4315 (1992)CrossRefGoogle Scholar
- 37.S. Nishikiori, C.I. Ratcliffe, J.A. Ripmeester, J. Phys. Chem. 95, 1589 (1991)CrossRefGoogle Scholar
- 38.M.J. Duer, M.H. Levitt, Solid State Nucl. Magn. Reson. 1, 211 (1992)CrossRefGoogle Scholar
- 39.J.C. Williams, A.E. McDermott, J. Chem. Phys 97, 12393 (1993)CrossRefGoogle Scholar
- 40.D. Reichert, Z. Olender, R. Poupko, H. Zimmerman, Z. Luz, J. Chem. Phys. 98, 7699 (1993)ADSCrossRefGoogle Scholar
- 41.Y.Y. Huang, R.L. Vold, G.L. Hoatson, J. Chem. Phys. 124, 104504 (2006)ADSCrossRefGoogle Scholar
- 42.R. Freeman, Chem. Rev. 91, 1397 (1991)CrossRefGoogle Scholar
- 43.F.W. Dahlquist, K.J. Longmuir, R.B. Du Vernet, J. Magn. Reson. 17, 406 (1975)ADSGoogle Scholar
- 44.A.D. Bain, Prog. Nucl. Magn. Reson. Spectrosc. 43, 63 (2003)CrossRefGoogle Scholar
- 45.J. Jeener, B.H. Meier, P. Bachmann, R.R. Ernst, J. Chem. Phys 71, 4546 (1979)ADSCrossRefGoogle Scholar
- 46.D.J. States, R.A. Haberkorn, D.J. Ruben, J. Magn. Reson. 48, 286 (1982)ADSGoogle Scholar
- 47.C.L. Perrin, T.J. Dwyer, Chem. Rev. 90, 935 (1990)CrossRefGoogle Scholar
- 48.J. Fejzo, W.M. Westler, S. Macura, J.L. Markley, J. Magn. Reson. 92, 20 (1991)ADSGoogle Scholar
- 49.D. Marion, K. Wüthrich, Biochem. Biophys. Res. Comm. 113, 967 (1983)CrossRefGoogle Scholar
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