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Time-dependent density functional theory with ultrasoft pseudopotentials: Real-time electron propagation across a molecular junction

Time-dependent density functional theory with ultrasoft pseudopotentials: Real-time electron propagation across a molecular junction

Qian, Xiaofeng; Li, Ju; Lin, Xi; Yip, Sidney

期刊名称Physical Review B
作者Qian, Xiaofeng; Li, Ju; Lin, Xi; Yip, Sidney
卷第73卷
期第3期
印刷ISSN1098-0121
电子ISSN1550-235X
文件大小632.40KB
发表时间2006-1-5
DOI10.1103/PhysRevB.73.035408

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