2023
DOI: 10.1021/acs.energyfuels.3c02756
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DFT Study of the Cooperative Promotion of MgO and ZnO on CaCO3/CaO Thermochemical Heat Storage Performance of CaO

Youhao Zhang,
Yingjie Li,
Yi Fang
et al.

Abstract: CaCO3/CaO thermochemical heat storage is one of the most prospective schemes for large-scale heat storage in the next-generation concentrated solar power plants. MgO and ZnO can cooperatively enhance the heat storage performance of CaO. However, the underlying mechanism for the cooperative promotion of MgO and ZnO on the heat storage performance of CaO remains unidentified. In this work, density functional theory (DFT) calculations were applied to analyze the role of MgO and ZnO in CaCO3/CaO heat storage proce… Show more

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