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Infrared Spectra and Theoretical Calculations of BS2 and BS2-: Strong Pseudo Jahn-Teller Effect

BS2和BS2-分子的红外光谱和Jahn—Teller效应
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摘要 Laser ablated boron atoms have been reacted with hydrogen sulfide and the reaction products condensed with argon at 4 K, which gave BS2, BS2-, HSBS, and HBS molecules. Reagent isotopic substitution (H2S, H234S, D2S, 10 B, 11B) and variation of boron and hydrogen sulfide concentrations have been used to identify the major products. Both BS2-- and BS2 were identified as linear molecules with no significant difference in the structure parameters, but the B-S anti-symmetric stretching vibration of BS2 is significantly lower than that of BS2-, which is ascribed to pseudo Jahn-Teller effect. Theoretical calculation was employed to have an insight into the interaction nature of the bonds in the corresponding products.
出处 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2017年第6期678-684,I0002,共8页 化学物理学报(英文)
关键词 Matrix isolation Pseudo Jahn-Teller effect Multicenter bond 低温基质隔离 Jahn—Teller效应 多重化学键
分类号 O [理学]
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