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Analysis of atomic zinc luminescence in rare-gas solids A zinc-rare gas cluster approach

机译:稀有气体固体中原子锌发光的分析稀有锌气体团簇方法

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摘要

The luminescence spectroscopy of atomic zinc isolated in the solid rare gases (ZnRG) is compared with theoretical predictions obtained with the use of diatomic Zn·RG potentials. In particular, the existence of pairs of emission bands, both of which are assigned to the same gas-phase electronic transition, is examined with the use of diatomic pair potentials to simulate the potential-energy surfaces of the Jahn-Teller active vibrational modes of Zn in the solid. The close agreement found between theory and experiment indicates the validity of the use of pair potentials in the analysis of matrix zinc spectroscopy. Thus, it allows identification of the high-energy emission bands in the ZnRG systems as arising from motions of the rare-gas atoms surrounding the atomic zinc guest and the lower-energy bands as associated with the motion of the zinc atom into an octahedral interstitial site in the lattice.
机译:将固体稀有气体(ZnRG)中分离出的原子锌的发光光谱与使用双原子Zn·RG电势获得的理论预测进行了比较。特别是,使用双原子对势来模拟Jahn-Teller主动振动模态的势能表面,检查了两个都分配给相同气相电子跃迁的发射带对的存在。固体中的锌。理论和实验之间的密切一致性表明,在基质锌光谱分析中使用对电位是有效的。因此,它可以确定ZnRG系统中的高能发射带是由于原子锌客人周围的稀有气体原子的运动引起的,而较低能带是与锌原子进入八面​​体间隙的运动相关的格中的位置。

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