反键分子轨道
谱线
稀土
材料科学
电子能带结构
原子物理学
光导率
电子结构
离子
原子电子跃迁
凝聚态物理
电子
物理
量子力学
原子轨道
冶金
天文
作者
Shin‐ichi Kimura,Tetsuya Nanba,M. Tomikawa,S. Kunii,T. Kasuya
出处
期刊:Physical review
日期:1992-11-15
卷期号:46 (19): 12196-12204
被引量:84
标识
DOI:10.1103/physrevb.46.12196
摘要
Reflectivity spectra of all rare-earth hexaboride R${\mathrm{B}}_{6}$ (R=La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy, Ho, Yb, and Y) single crystals have been measured systematically in the energy region from 1 meV to 40 eV at 300 K in order to investigate the electronic state and the contribution of the 4f electron to the band structure. The analysis of the optical conductivity and the loss-function spectra, which were derived from the Kramers-Kronig transformation of the reflectivity spectra, allowed us to make clear the origin of the peak structure in the spectrum due to the various interband transitions. The origins of the main peaks in the spectrum were assigned to the interband transitions from the bonding to the antibonding bands of the boron 2s and 2p states and to the rare-earth 5d state. The intra-atomic transition from the 4f and the 5p to the 5d(${\mathit{t}}_{2\mathit{g}}$) states in the rare-earth ion was also observed.
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