Theoretical investigation of chemical functionalization BxCyNz (x = z=1, y=2) nanotube with pralines amino acid

Xu, XQ; Wang, WQ; Luo, J; Mohamadi, A

Xu, XQ (corresponding author), Jiangsu Hlth Vocat Coll, Sci & Technol Branch, Nanjing 211800, Peoples R China.

COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2021; 1200 ():

Abstract

By using density functional theory (DFT) calculations, we investigated pralines amino acid interaction with (8, 0) zigzag single-wall BC2N nanotubes (......

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