Multi-reference calculations of the photodissociation of HSCH_3 molecule  

作　　者：闫冰 潘守甫 

机构地区：[1]Institute of Atomic and Molecular Physics,Jilin University

出　　处：《Chinese Physics B》2008年第4期1501-1505,共5页中国物理B（英文版）

基　　金：Project supported by the National Natural Science Foundation of China (Grant Nos 10604022 and 60278009)

摘　　要：This paper performs multi-reference second-order perturbation theory calculations on the ground state and a number of low-lying excited states of HSCH3 molecule, and calculates the vertical excitation energies and low-energy potential-energy curves, based on which the photodissociation channels of HSCH3 at 193,222,248 nm are clarified.This paper performs multi-reference second-order perturbation theory calculations on the ground state and a number of low-lying excited states of HSCH3 molecule, and calculates the vertical excitation energies and low-energy potential-energy curves, based on which the photodissociation channels of HSCH3 at 193,222,248 nm are clarified.

关 键 词：PHOTODISSOCIATION potential-energy curve HSCH3 molecule 

分 类 号：O561[理学—原子与分子物理]