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Adsorption of 3-picrylamino-1,2,4-triazole on C60 surface as a green fuel: DFT studies
Adsorption of 3-picrylamino-1,2,4-triazole on C60 surface as a green fuel: DFT studies

Maryam Godarzi; Roya Ahmadi; Reza Ghiasi

Volume 4, Issue 2 , April 2020, , Pages 220-230

https://doi.org/10.22034/AJGC/2020.2.9

Abstract
  In this study, the adsorption of 3-picrylamino-1,2,4-triazole (PATO) On the surface of fullerene (C60) was evaluated by density functional theory using, Becke, three-parameter and Lee-Yang-Parr ...  Read More