Xiaotong Ma,Xingkang Huang,Tai Feng,Mingfei Mu,Xiude Hu
出处
期刊：Reaction Chemistry and Engineering [The Royal Society of Chemistry] 日期：2021-12-21卷期号：7 (3): 758-768被引量：5
标识
DOI：10.1039/d1re00487e
摘要
HCl exhibits a preferred interaction with the O atom of CaO (100) surface, with the adsorption energy of −1.85 eV. HCl and CO 2 are in competition with one another at the O site. The presence of HCl inhibits CO 2 adsorption and promotes CO 2 desorption.
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