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Multidimensional quantum dynamics and infrared spectroscopy of hydrogen bonds
Authors:K. Giese,M. Petković,H. Naundorf,O. Kü  hn
Affiliation:1. Institut für Chemie und Biochemie, Freie Universität Berlin, Takustr. 3, D-14195 Berlin, Germany;2. Faculty of Physical Chemistry, University of Belgrade, Studentski trg 12, 11 000 Belgrade, Serbia
Abstract:Hydrogen bonds are of outstanding importance for many processes in Chemistry, Biology, and Physics. From the theoretical perspective the small mass of the proton in a hydrogen bond makes it the primary quantum nucleus and the phenomena one expects to surface in a particular clear way are, for instance, zero-point energy effects, quantum tunneling, or coherent wave packet dynamics. While this is well established in the limit of one-dimensional motion, the details of the multidimensional aspects of the dynamics of hydrogen bonds are just becoming accessible to experiments and numerical simulations.
Keywords:33.20.Ea   03.65.Sq   03.65.Xp   03.65.Yz   82.20.&minus  w   82.30.Rs   82.53.&minus  k
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