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Published in 2017 at "Modern Physics Letters B"
DOI: 10.1142/s0217984917500683
Abstract: This paper reports on semilocal and hybrid density functional analysis of charge-transition levels of native defects in BaF2 structure. The transition level is defined as the Fermi level where two defect charge states have the…
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Keywords:
levels native;
transition;
charge;
transition levels ... See more keywords