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Nitrogen–phosphorus doped graphitic nano onion-like structures: experimental and theoretical studies

Armando D. Martínez-Iniesta, Aaron Morelos‐Gómez, Emilio Muñoz‐Sandoval, Florentino Lopéz‐Urías

2021RSC Advances38 citationsDOIOpen Access PDF

Abstract

fullerenes. We present the optimized structures, electronic density of states, HOMO, and LUMO wave functions for P-doped and OH-functionalized fullerenes. The P[double bond, length as m-dash]O and P-O bonds attributed to phosphates or hydroxyl groups attached to phosphorus atoms doping the NP-GNOs could be useful in improving supercapacitor function.

Topics & Concepts

PhosphorusNitrogenDopingNano-Materials scienceNanotechnologyChemistryMetallurgyOrganic chemistryComposite materialOptoelectronicsAdvancements in Battery MaterialsGraphene research and applicationsSupercapacitor Materials and Fabrication