国家/地区 Iran（7）
关键词 DFT（6） GRAPHENE（4） N2O REDUCTION（2）
出版物 CHEMICAL PHYSICS LETTERS（7）
出版时间 2016（2） 2017（2） 2018（2）
机构 UNIV MARAGHE.（6）
作者 ESRAFILI MD（7）

N2O + CO reaction over a single Si or P atom incorporated nitrogen-doped graphene: A comparative DFT study

CHEMICAL PHYSICS LETTERS

ESRAFILI MD

BN co-doped graphene monolayers as promising metal-free catalysts for N2O reduction: A DFT study

CHEMICAL PHYSICS LETTERS

ESRAFILI MD

A DFT study on catalytic epoxidation of ethylene over Ti-doped graphene nanoflake in the presence of NO molecules

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, SAEIDI N, DINPARAST L

A DFT study on the catalytic hydrogenation of CO2 to formic acid over Ti-doped graphene nanoflake

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, DINPARAST L

A DFT study on SO3 capture and activation over Si- or Al-doped graphene

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, SAEIDI N, NEMATOLLAHI P

Si-doped graphene: A promising metal-free catalyst for oxidation of SO2

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, SAEIDI N, NEMATOLLAHI P

Catalytic role of B atoms in CO oxidation on B-doped graphene

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, MOUSAVIAN P