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首页> 外文期刊>The Journal of Chemical Physics >Resonance Raman spectroscopy of matrix-isolated mass-selected Fe_3 and Ag_3
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Resonance Raman spectroscopy of matrix-isolated mass-selected Fe_3 and Ag_3

机译:基质分离的质量选择的Fe_3和Ag_3的共振拉曼光谱

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摘要

Raman spectroscopy of matrix-isolated, mass-selected Fe_3 and Ag_3 reveal that both are Jahn-Teller distorted triangular molecules. The observed spectrum of Ag_3 can be accounted for adequately using an approximate Jahn-Teller potential truncated at the quadratic term [Wedum et al., J. Chem. Phys. 100,6312 (1994)] with parameters #omega#_a = 119 cm~(-1), #omega#_e = 99 cm~(-1) , k = 1.92, and g = 0.29. For Fe_3, the spectrum is more complex, most likely due to the fact that spin-orbit coupling plays an important role in this high-spin cluster in addition to the quadratic Jahn-Teller terms. The overall pattern of the spectrum suggests that in Fe_3 the Jahn-Teller distortion is likely small, and a peak at 249 cm~(-1) is tentatively assigned to its symmetric stretch.
机译:基质分离的,质量选择的Fe_3和Ag_3的拉曼光谱表明,它们都是Jahn-Teller扭曲的三角分子。可以使用在二次项处截断的近似Jahn-Teller电位来充分解释Ag_3的观察光谱[Wedum等,J。Chem。物理100,6312(1994)],其中参数#omega#_a = 119 cm〜(-1),#omega#_e = 99 cm〜(-1),k = 1.92,g = 0.29。对于Fe_3,光谱更为复杂,这很可能是由于自旋轨道耦合除二次Jahn-Teller项外还在此高自旋簇中起着重要作用。光谱的总体模式表明,在Fe_3中,Jahn-Teller畸变可能很小,并且在249 cm〜(-1)处的一个峰暂定为其对称伸展。

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