DFT research on activation of sphalerite

来源 :Transactions of Nonferrous Metals Society of China | 被引量 : 0次 | 上传用户:xjl982050
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Activation of sphalerite ZnS, (Zn, Fe)S, (Zn, Cu)S were carried out using the density functional theory (DFT) method. The electronic structures and related properties of three kind of zinc sulfide compounds were investigated. In addition, the relation bet
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