On the prediction of the crystal and electronic structure of mixed-valence materials by periodic density functional calculations: The case of Prussian Blue

标题
On the prediction of the crystal and electronic structure of mixed-valence materials by periodic density functional calculations: The case of Prussian Blue
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 128, Issue 4, Pages 044713
出版商
AIP Publishing
发表日期
2008-01-30
DOI
10.1063/1.2824966

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