日本金属学会2024年秋期(第175回)講演大会

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3.Microstructure » Microstructure

[P] P115~P131

Wed. Sep 18, 2024 2:00 PM - 3:30 PM Poster Session Room1 (Assembly Hall at Osaka Univ. Hall)

2:00 PM - 3:30 PM

[P131] Functionalized M2CTX (M=Sc, Ti, V, Cr, and Mn) sheet as an electrode material for lithium-ion battery via ab initio calculation

*Jiwoo Choi1, Hyokyeong kim1, Inseong Bae1, Hayoung Son1, Jiwoong Kim1,2 (1. Department of Materials Science and Engineering, Soongsil University, Seoul 06978, Republic of Korea, 2. Department of Green Chemistry and Materials Engineering, Soongsil University, Seoul 06978, Republic of Korea)

Keywords:lithium-ion batteries、anode、ab initio calculations、MXene、MAX phase

Ab initio calculations were used to explore the suitability of functionalized MXene M2CTX (M = Sc, Ti, V, Cr, and Mn; TX = Cl, Br, S, Se, O, and Te) as electrode materials.

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