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Photoelectron Spectroscopy of 4-Bromochlorobenzene Dimer and Trimer Anions

机译:4-溴氯苯二聚体和三聚体阴离子的光电子能谱

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摘要

Clusters are the aggregates of molecules or ions which have intrinsic properties that are not found in their monomer unit. Their structure and charge distribution greatly affect the properties of the clusters. Charge resonance is the key factor that determines the structure of the cation clusters of aromatic hydrocarbons. T. Shida and S. Iwata also calculated the charge resonance band and observed it experimentally, With advances in molecular beam apparatus and quantum calculations, anion clusters have been extensively studied. Benzene does not form a stable dimer anion in the gas phase, and naphthalene forms a dimer anion which may have T-shaped geometry due to the strong repulsion from the π-electron. Dimer anions larger than naphthalene all have parallel-displaced (PD) geometries with charge resonance. Sometimes homocluster anions show ion core switching with the increase of the cluster size.
机译:簇是分子或离子的聚集体,这些分子或离子具有在其单体单元中未发现的固有特性。它们的结构和电荷分布极大地影响了团簇的性质。电荷共振是决定芳烃阳离子簇结构的关键因素。 T. Shida和S. Iwata还计算了电荷共振带并进行了实验观察,随着分子束装置和量子计算的发展,阴离子团簇得到了广泛的研究。苯在气相中不形成稳定的二聚阴离子,而萘形成由于来自π电子的强排斥而可能具有T形几何形状的二聚阴离子。大于萘的二聚阴离子均具有平行位移(PD)几何结构并带有电荷共振。有时同族阴离子显示出随着簇尺寸的增加离子核的转换。

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