国家/地区 Iran（6）
关键词 DFT（6）
出版物 CHEMICAL PHYSICS LETTERS（6）
出版时间 2017（2） 2018（2）
机构 UNIV MARAGHE.（5）
作者 ESRAFILI MD（6）

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

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

CHEMICAL PHYSICS LETTERS

ESRAFILI MD, MOUSAVIAN P