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Supplementary materials: Electronic structure, phase stability and local structural of Li-doped (K,Na)NbO3 under hydrostatic pressure from first principles calculation

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Figshare2023-02-14 更新2026-04-08 收录
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Atomic position for (K,Na,Li)NbO3 for different unit cell configurations under applied pressure using density functional theory with planewave basis set and GGA xc.

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2023-02-14
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