Calculations of Hubbard U from first-principles
作者： F. Aryasetiawan , K. Karlsson , O. Jepsen , U. Schönberger
DOI: 10.1103/PHYSREVB.74.125106
关键词:
摘要: … In analogy to the constrained LDA method, we refer the method of calculating the Hubbard U as in Eq. 3 as “constrained RPA” CRPA because we have constrained the polarization to …
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sci-hub.se 参考文章(22)
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