@article{paperid:1085458,
author = {Kheirabadi, Ramesh and Vakili, Mohamad},
title = {Computational modeling in enhanced CO2 and C2H2 capture on chalcogen atom (Se, Te)-decorated graphene: structural and mechanistic aspects},
journal = {Journal of the Iranian Chemical Society},
year = {2021},
volume = {19},
number = {2},
month = {June},
issn = {1735-207X},
pages = {447--461},
			numpages = {14},
keywords = {Density functional theory· Graphene· Nonmetal selenium and tellurium site· Density of state· Adsorption energy· Enhanced CO2/C2H2 capture},
}