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Published in 2021 at "Chemical Physics Letters"
DOI: 10.1016/j.cplett.2020.138101
Abstract: Abstract Interactions between transition metals (Cr, Mn, Fe, Co, Pt and Au) modified single vacancy graphene and lithium polysulfides have been studied based on the first-principle calculations. By studying the binding energies, adsorption structures, charge…
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Keywords:
vacancy graphene;
single vacancy;
modified single;
lithium ... See more keywords