国家/地区 China（2）
关键词 GRAPHENE（3） ADSORPTION（2） DENSITY FUNCTIONAL .（2）
DFT（2）
出版物 JOURNAL OF MOLECULAR GRAPHICS MODELLING（6）
出版时间 2020（6）
机构
作者

Electronic structure, cohesive and magnetic properties of iridium oxide clusters adsorbed on graphene

JOURNAL OF MOLECULAR GRAPHICS MODELLING

AYSAN II, GORKAN T, OZDEMIR I, KADIOGLU Y, GOKOGLU G, AKTURK E

A DFT-D2 study on the adsorption of phosgene derivatives and chloromethyl chloroformate on pristine and Fe-4-decorated graphene

JOURNAL OF MOLECULAR GRAPHICS MODELLING

JOGENDER, BADHANI B, MANDEEP, KAKKAR R

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

Theoretical study of collision dynamics of fullerenes on graphenylene and porous graphene membranes

JOURNAL OF MOLECULAR GRAPHICS MODELLING

BRANDOLT R, PAUPITZ R

Graphene-like boron carbide monolayer as an electronic and work function-type sensor for dopamine drug

JOURNAL OF MOLECULAR GRAPHICS MODELLING

DING WY, ZHANG X, WU YL, WU L

CuN3 doped graphene as an active electrocatalyst for oxygen reduction reaction in fuel cells: A DFT study

JOURNAL OF MOLECULAR GRAPHICS MODELLING

MOHAMMADIRAD N, ESRAFILI MD, SARDROODI JJ