NONLINEARLY VIBRATIONAL ENERGY-SPECTRA OF MOLECULAR CRYSTALS
Pang Xiao-feng (庞小峰)ab, Chen Xiang-rong (陈向荣)b
a Institute of High-Energy Electronics, University of Electronic Science and Technology of China, Chengdu 610054, and International Centre for Material Physics, Chinese Academy of Sciences, Shenyang 110015, China; b Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065, China
Abstract The nonlinear quantum vibrational energy spectra of amide-I in the molecular crystals acetanilide are calculated by using the discrete nonlinear Schr$\ddot{\rm o}$dinger equation appropriate to this kind of crystals.The numerical results obtained by this method are in good agreement with the experimental values. Meanwhile, the energy levels at high excited states have also been obtained for the acetanilide, which is helpful in researching the Raman scattering and infrared absorption properties of the this kind of crystals.
Received: 04 July 1999
Revised: 09 August 1999
Accepted manuscript online:
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