国家/地区 China（4） Uruguay（4） India（2） Iran（2）
关键词 DFT（15）
出版物 APPLIED SURFACE SCIENCE（15）
出版时间 2018（15）
机构 UNIV REPUBLI.（4） SRM INST SCI.（2） UNIV MARAGHE.（2）
作者 FACCIO R（4） MOMBRU AW（4） MOMBRU D（4） ESRAFILI MD（2）
JANANI K（2） MOUSAVIAN P（2） THIRUVADIGAL.（2）

Curvature and vacancies in graphene quantum dots

APPLIED SURFACE SCIENCE

MOMBRU D, ROMERO M, FACCIO R, MOMBRU AW

DFT study on the electronic structure and optical properties of N, Al, and N-Al doped graphene

APPLIED SURFACE SCIENCE

ZHOU X, ZHAO CH, WU GF, CHEN JH, LI YQ

Sulfur doping in multivacancy graphene systems

APPLIED SURFACE SCIENCE

MOMBRU D, FACCIO R, MOMBRU AW

A DFT study of Li adsorption on surface of Si clusters anchored N-doped defective graphene composite

APPLIED SURFACE SCIENCE

HU RQ, ZHOU JQ

Boosting graphene reactivity with co-doping of boron and nitrogen atoms: CO oxidation by O-2 molecule

APPLIED SURFACE SCIENCE

ESRAFILI MD, MOUSAVIAN P

Density functional study on covalent functionalization of zigzag graphene nanoribbon through L-Phenylalanine and boron doping: Effective nanocarriers in drug delivery applications

APPLIED SURFACE SCIENCE

JANANI K, THIRUVADIGAL DJ

Adsorption of essential minerals on L-glutamine functionalized zigzag graphene nanoribbon-A first principles DFT study

APPLIED SURFACE SCIENCE

JANANI K, THIRUVADIGAL DJ

DFT study of hydrogen adsorption on Ni/graphene

APPLIED SURFACE SCIENCE

AMAYARONCANCIO S, BLANCO AAG, LINARES DH, SAPAG K

The promotion effects of graphitic and pyridinic N combinational doping on graphene for ORR

APPLIED SURFACE SCIENCE

YAN P, LIU J, YUAN SD, LIU YJ, CEN WL, CHEN YQ

Stability of boron-doped graphene/copper interface: DFT, XPS and OSEE studies

APPLIED SURFACE SCIENCE

BOUKHVALOV DW, ZHIDKOV IS, KUKHARENKO AI, SLESAREV AI, ZATSEPIN AF, CHOLAKH SO, KURMAEV EZ