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Solvent effects on the S0S2 absorption spectra of β-carotene
作者姓名:刘伟龙  王德敏  郑植仁  李艾华  苏文辉
作者单位:Center for Condensed-Matter Science and Technology, Harbin Institute of Technology, Harbin 150001, China;Center for Condensed-Matter Science and Technology, Harbin Institute of Technology, Harbin 150001, China;Center for Condensed-Matter Science and Technology, Harbin Institute of Technology, Harbin 150001, China;Center for Condensed-Matter Science and Technology, Harbin Institute of Technology, Harbin 150001, China;Center for Condensed-Matter Science and Technology, Harbin Institute of Technology, Harbin 150001, China;International Center for Materials Physics, Chinese Academy of Sciences, Shenyang 110015, China
基金项目:Project supported by the NationalNatural Science Foundation of China (Grant No. 10774034).
摘    要:Absorption spectra of β -carotene in 31 solventsare measured in ambient conditions. Solvent effects on the 0--0 bandenergy, the bandwidth, and the transition moment of the S0 →S2 transition are analysed. The discrepancies between publishedresults of the solvent effects on the 0--0 band energy areexplained by taking into account microscopic solute-solventinteractions. The contributions of polarity and polarizability ofsolvents to 0--0 band energy and bandwidth are quantitativelydistinguished. The 0--0 transition energy of the S2 state at the gasphase is predicted to locate between 23000 and 23600~cm-1.

收稿时间:2009-05-25
修稿时间:2009-07-08
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