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The Perdew–Burke–Ernzerhof exchange-correlation functional applied to the G2-1 test set using a plane-wave basis set

The Perdew–Burke–Ernzerhof exchange-correlation functional applied to the G2-1 test set using a plane-wave basis set

Paier, Joachim; Hirschl, Robin; Marsman, Martijn; Kresse, Georg

期刊名称The Journal of Chemical Physics
作者Paier, Joachim; Hirschl, Robin; Marsman, Martijn; Kresse, Georg
卷第122卷
期第23期
印刷ISSN0021-9606
文件大小430.07KB
发表时间2005
DOI10.1063/1.1926272

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