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Published in 2019 at "Superlattices and Microstructures"
DOI: 10.1016/j.spmi.2019.04.044
Abstract: Abstract The structural and electronic properties of vacancy-doped 1H and 1T′ MoTe2 monolayers are systematically investigated based on first-principles calculations. Te vacancy is found energetically favored over Mo vacancy for both phases, and Te double…
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Keywords:
vacancy doped;
defect states;
flat bands;
vacancy ... See more keywords