Solubility of Aminotriethylene Glycol Functionalized Single Wall Carbon Nanotubes: A Density Functional Based Tight Binding Molecular Dynamics Study
Pristine CNTs are exemplary hydrophobic solutes; properly functionalized CNTs can be seen as hydrophilic ones. The solubility of aminotriethylene glycol (ATG) functionalized single walled carbon nanotubes (fSWCNTs) were examined using density functional based tight binding method. According to the d...
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Main Authors: | Mananghaya, Michael Rivera, Santos, Gil N, Yu, Dennis |
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Format: | text |
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Archīum Ateneo
2019
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Online Access: | https://archium.ateneo.edu/physics-faculty-pubs/112 https://onlinelibrary.wiley.com/doi/10.1002/jcc.25776 |
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Institution: | Ateneo De Manila University |
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