How boron is adsorbed by oxygen-containing groups functionalized graphene: A density functional theory study

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DOI:10.1016/j.seppur.2023.125551
文献类型：期刊论文
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Elsevier

Abstract：We employed density functional theory to investigate the adsorption mechanism of B(OH)3 and B(OH)4− on different graphene models: graphene with 20 carbon rings (G20), hydroxyl-modified graph

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