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Bader charge distribution of the 1T-MnO2 monolayer, where Q is the charge of the free atom, Q* is the charge of the bonded atom, ∆Q the charge variation, and n the atomic charge density.

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Figshare2025-11-14 更新2026-04-28 收录
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Bader charge distribution of the 1T-MnO2 monolayer, where Q is the charge of the free atom, Q* is the charge of the bonded atom, ∆Q the charge variation, and n the atomic charge density.

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2025-11-14
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