Calculation on surface energy and electronic properties of CoS2
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DOI: 10.1098/rsos.191653
Abstract: Density functional theory was employed to investigate the (111), (200), (210), (211) and (220) surfaces of CoS2. The surface energies were calculated with a sulfur environment using first-principle-based thermodynamics. It is founded that surfaces with… read more here.
Keywords: energy electronic; calculation surface; energy; surface ... See more keywords