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Monolayer α-beryllene as an anode material for magnesium ion batteries with high capacity and low diffusion energy barrier

Qiang GaoCollege of Integrated Circuit Science and Engineering, Nanjing University of Posts and Telecommunications, Nanjing 210023, ChinaXiao-Juan YeCollege of Integrated Circuit Science and Engineering, Nanjing University of Posts and Telecommunications, Nanjing 210023, ChinaChun-Sheng LiuCollege of Electronic and Optical Engineering, Nanjing University of Posts and Telecommunications, Nanjing 210023, China
2023en
ABI

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for Mg, a low average open-circuit voltage of 0.24 V, and a tiny volume change of -1.08%. Finally, the constructed h-BN/α-beryllene heterostructure shows that h-BN can serve as a protective cover to preserve pristine α-beryllene in respect of metallicity, Mg adsorption capability, and fast ionic mobility. The above mentioned outstanding results make α-beryllene a promising anode material for magnesium-ion batteries.

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