Accurate density functional calculations of near-edge x-ray and optical absorption spectra of liquid water using nonperiodic boundary conditions: the role of self-interaction and long-range effects.
第一作者:
Giuseppe,Brancato
第一单位:
Dipartimento di Chimica, Università Federico II, Complesso Universitario di Monte S. Angelo, via Cintia, I-80126 Napoli, Italy.
作者:
DOI
10.1103/PhysRevLett.100.107401
PMID
18352228
发布时间
2008-03-20
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Physical review letters
107401页
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