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 |
本文献已被 ScienceDirect 等数据库收录! |
|