The adsorption characteristics and thermo-mechanical properties of BxCyNz heteronanotubes under physical adsorption of Ni(II)-tetramethyldibenzotetraaza[14]annulene (NiTMTAA): Insight from molecular dynamics approach
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DOI: 10.1016/j.commatsci.2020.109554
Abstract: Abstract In this study, the adsorption characteristics together with the modified thermomechanical properties of stable BxCyNz heteronanotubes, i.e. BC2N, BC3, and NC3, in ambient conditions have been explored under the adsorption of NiTMTAA molecules (NiTMTAA/heteronanotube).… read more here.
Keywords: adsorption; molecular dynamics; adsorption characteristics; nitmtaa molecules ... See more keywords