国家/地区 Iran（4） China（2）
关键词 DFT（7）
出版物 APPLIED SURFACE SCIENCE（7）
出版时间 2019（7）
机构 UNIV MARAGHE.（2）
作者 ESRAFILI MD（2）

Controlling the electronic properties of zigzag graphene nanoribbon using amino acids and oxygen molecule-A first principles DFT study

APPLIED SURFACE SCIENCE

KUMAR J, MOHANRAJ HR, CHRISTIAN PK, DAVID JT

Si-coordinated nitrogen doped graphene: A robust and highly active catalyst for NO plus CO reaction

APPLIED SURFACE SCIENCE

ESRAFILI MD, VATANZADEH M

Theoretical insight into the role of pyridinic nitrogen on the catalytic activity of boron-doped graphene towards oxygen reduction reaction

APPLIED SURFACE SCIENCE

LARIJANI HT, KHORSHIDIAN M

A DFT study of CO adsorption on the pristine, defective, In-doped and Sb-doped graphene and the effect of applied electric field

APPLIED SURFACE SCIENCE

YANG SL, LEI G, XU HX, XU B, LI HP, LAN ZG, WANG Z, GU HS

Adsorption characteristics of Co-anchored different graphene substrates toward O-2 and NO molecules

APPLIED SURFACE SCIENCE

DONG JL, GAO ZY, YANG WJ, LI A, DING XL

Theoretical studies on the mechanical and electronic properties of 2D and 3D structures of Beryllium-Oxide graphene and graphene nanobud

APPLIED SURFACE SCIENCE

MASHHADZADEH AH, AHANGARI MG, DADRASI A, FATHALIAN M

Theoretical insights into hydrogenation of CO2 to formic acid over a single Co atom incorporated nitrogen-doped graphene: A DFT study

APPLIED SURFACE SCIENCE

ESRAFILI MD, NEJADEBRAHIMI B