Joint experimental and theoretical study of vibrationally inelastic electron scattering on propane.
作者信息
Popović Duska B, David Donald E, Michl Josef, Curík Roman, Cársky Petr
机构信息
Department of Chemistry and Biochemistry, University of Colorado, Boulder, CO 80309-0215, USA.
出版信息
J Chem Phys. 2004 Dec 1;121(21):10551-5. doi: 10.1063/1.1807372.
PMID:15549938
Abstract
Vibrational electron energy loss spectra were measured for propane at incident energies of 3, 6, 10, 15, 20, and 25 eV at scattering angles of 40 degrees, 55 degrees, 70 degrees, 85 degrees, and 100 degrees . The spectra are compared with the results of ab initio calculations using a recently developed two-channel discrete momentum representation method. Good agreement between theory and experiment was found for large scattering angles and energies above the resonant region.
摘要
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