文件名称：Effect of vacancy defects on electronic properties and activation of sphalerite (110) surface by first-principles (2010年)
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更新时间：2024-05-12 03:29:29
工程技术 论文
The electronic properties of sphalerite (110) surface with Zn-vacancy and S-vacancy were calculated by using density-functional theory, and the effects of vacancy defect on the copper activation of sphalerite were investigated. The calculated results indi