钒
X射线光电子能谱
化学
价(化学)
锡
电子结构
金属
电子能带结构
无机化学
谱线
结晶学
分析化学(期刊)
计算化学
核磁共振
物理
天文
量子力学
有机化学
色谱法
作者
Wolfgang Bensch,Robert Schlögl
标识
DOI:10.1006/jssc.1993.1322
摘要
A combined UPS and XPS study was performed on a series of structurally related vanadium sulfides of the NiAs type. The valence band spectra show systematic variations with the metal to sulfur ratio (1.0 to 1.6) such as an increase in the density of states with increasing sulfur content. These findings are discussed using structural information and band structure calculations of VS at the linear Muffin-Tin orbital (LMTO) level. The core level data of S 2p, S 2s, and V 2p exhibit much larger variations than expected from the valence band spectra indicating that the bonding interaction in the VS6 octahedra vary with the elemental composition. The compounds contain a significant amount of dissolved atomic oxygen which forms oxides only after Ar ion bombardment. The presence of nonbonding oxygen was substantiated with XPS and IMR-MS thermal desorption spectroscopy. All data point to an alloy type electronic structure of these metalloid compounds resulting from a vanadium atom network with metallic contacts varying systematically in its topology with chemical composition.
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