Large-scale DFT simulation of quinone molecules encapsulated in single-walled carbon nanotube for novel Li-ion battery cathode
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DOI: 10.1016/j.commatsci.2019.109281
Abstract: Abstract A system of quinone molecules encapsulated in single-walled carbon nanotubes (SWCNTs) has been proposed as a next-generation cathode material for rechargeable batteries [Y. Ishii et al., Phys. Chem. Chem. Phys. 18 (2016) 10411–10418]. We… read more here.
Keywords: swcnt; molecules encapsulated; quinone; encapsulated single ... See more keywords