Neutron inelastic scattering spectrum and valence force field for neopentane |
| |
| Authors: | H. Jobic S. Sportouch A. Renouprez |
| |
| Affiliation: | Institut Laue-Langevin, 156X, 38042 Grenoble Cedex, France;Laboratoire de Spectroscopie Moléculaire, USTL, 34060 Montpellier, France;Institut de Recherches sur la Catalyse, 2, av. Albert Einstein, 69626 Villeurbanne Cedex, France |
| |
| Abstract: | The neutron inelastic scattering spectrum of neopentane has been measured between 10 and 2000 cm?1. A partial reassignment of the normal modes of vibration is presented. A vibrational analysis based on the Snyder and Schachtschneider valence force field has been carried out using the frequencies of neopentane and neopentane-d12. The calculated neutron spectrum, using our new force field, is found to be in good agreement with the observed neutron data. |
| |
| Keywords: | |
| 本文献已被 ScienceDirect 等数据库收录！ |
|
