国家/地区 China（2）
关键词 DENSITY FUNCTIONAL THEORY（3）
出版物
出版时间 2022（2）
机构
作者 VAKILI M（3）

Computational investigation of N2O adsorption and dissociation on the silicon-embedded graphene catalyst: A density functional theory perspective

JOURNAL OF MOLECULAR GRAPHICS MODELLING

VAKILI M, GHOLIZADEH R, GHADI A, SALMASI E, SINNOKROT M

Intercalating negatively charged pillars into graphene oxide sheets to enhance sulfonamide pharmaceutical removal from water

ENVIRONMENTAL SCIENCE POLLUTION RESEARCH

WANG W, WANG SY, VAKILI M, WANG Y, SUN C, YANG HR, XIAO GT, GONG MJ, ZHOU SX

Computational modeling in enhanced CO2 and C2H2 capture on chalcogen atom (Se, Te)-decorated graphene: structural and mechanistic aspects

JOURNAL OF THE IRANIAN CHEMICAL SOCIETY

KHEIRABADI R, VAKILI M