Theoretical and experimental researches on NiS2 nanocubes with uniform reactive exposure facets
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DOI: 10.1016/j.matchemphys.2017.12.026
Abstract: Abstract First principles calculations were performed to systematically investigate the surface relaxation, surface stability, electronic structure of the pyrite NiS2. The results demonstrate that the stable order of the surface energy is (1 0 0) > (1… read more here.
Keywords: theoretical experimental; experimental researches; surface; chemistry ... See more keywords