国家/地区
关键词 DFT（2）
出版物 JOURNAL OF COMPUTATIONAL CHEMISTRY（2）
出版时间 2022（2）
机构
作者

Assessment of density functional approximations for N-2 and CO2 physisorption on benzene and graphene

JOURNAL OF COMPUTATIONAL CHEMISTRY

RAYON VM, CABRIA I

Investigation of glucose electrooxidation mechanism over N-modified metal-doped graphene electrode by density functional theory approach

JOURNAL OF COMPUTATIONAL CHEMISTRY

DUZENLI D, ONAL I, TEZSEVIN I