国家/地区 Iran（4）
关键词 DFT（2）
出版物 COMPUTATIONAL THEORETICAL CHEMISTRY（4）
出版时间 2016（2）
机构
作者

A DFT study on the catalytic ability of aluminum doped graphene for the initial steps of the conversion of methanol to gasoline

COMPUTATIONAL THEORETICAL CHEMISTRY

SHAHABI D, TAVAKOL H

Engineering of the electronic structure of graphene monoxide by out of plane and in-plane strains investigated by DFT

COMPUTATIONAL THEORETICAL CHEMISTRY

SARDROODI JJ, JALALINIA A, EBRAHIMZADEH AR

A comparative theoretical study of methane adsorption on the nitrogen, boron and lithium doped graphene sheets including density functional dispersion correction

COMPUTATIONAL THEORETICAL CHEMISTRY

HASSANI A, MOSAVIAN MTH, AHMADPOUR A, FARHADIAN N

DFT study of Ni-doped graphene nanosheet as a drug carrier for multiple sclerosis drugs

COMPUTATIONAL THEORETICAL CHEMISTRY

DASTANI N, ARAB A, RAISSI H