VASP Bader 电荷可视化工作台：ACF.dat + POSCAR → 交互式 3D 结构 · 旋转 GIF · 独立 HTML 报告 | Interactive Bader charge viewer & GIF/HTML report generator (PySide6 + 3Dmol.js)
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Updated
Oct 10, 2026 - Python
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charge-analysis
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