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Volumn 102, Issue 1, 2009, Pages
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Fully Ab initio finite-size corrections for charged-defect supercell calculations
a
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Author keywords
[No Author keywords available]
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Indexed keywords
DIAMONDS;
PROGRAMMING THEORY;
AB INITIO THEORIES;
AB-INITIO;
CELL SIZES;
CHARGED DEFECTS;
COMPUTATIONALLY EFFICIENT;
DIELECTRIC MEDIAS;
FINITE-SIZE CORRECTIONS;
GAAS;
PERIODIC BOUNDARY CONDITIONS;
RAPID CONVERGENCES;
RIGOROUS ANALYSIS;
SUPER CELLS;
SUPERCELL CALCULATIONS;
DEFECTS;
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EID: 58849141743
PISSN: 00319007
EISSN: 10797114
Source Type: Journal
DOI: 10.1103/PhysRevLett.102.016402 Document Type: Article |
Times cited : (1372)
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References (14)
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