国家/地区 China（8）
关键词 DFT（4） SINGLEATOM CATALYST（3）
出版物 MOLECULAR CATALYSIS（8）
出版时间 2022（8）
机构
作者 XU H（2）

CuZn@N-doped graphene layer for upgrading of furfural to furfuryl alcohol

MOLECULAR CATALYSIS

YAN XQ, ZHANG GY, ZHU QQ, KONG XJ

A theoretical study on molybdenum and sulfur co-doped graphene for electrocatalytic nitrogen reduction

MOLECULAR CATALYSIS

QIN YY, ZHANG SS, GAO GX, DING SJ, SU YQ

Theoretical analysis of selective catalytic oxidation of H2S on Fe-N(3 )co-doped graphene

MOLECULAR CATALYSIS

LI Y, YANG YY, LI K, SUN X, WANG F, HAO YJ, NING P, WANG C

Mechanism of formaldehyde oxidation catalyzed by doped graphene single atom catalysts: Density functional theory study

MOLECULAR CATALYSIS

LIU ST, NIU SL, LIU JW, WANG D, WANG YZ, HAN KH

Computational screening of TMN4 based graphene-like BC6N for CO2 electroreduction to C-1 hydrocarbon products

MOLECULAR CATALYSIS

XU F, WANG XH, LIU X, LI CY, FAN GH, XU H

Synergize curvature and confinement effects for Fe-, Co-, Ni- N-2 sites on graphene nanobuds towards eNRR

MOLECULAR CATALYSIS

HAN XQ, YANG T, ZHANG FY, LANG ZL, XU HL, SU ZM

Revealing the intrinsic relation between heteroatom dopants and graphene quantum dots as a bi-functional ORR/OER catalyst

MOLECULAR CATALYSIS

YANG M, LIAN Z, SI CW, JAN F, LI B

Porous aza-doped graphene-analogous 2D material a unique catalyst for CO2 conversion to formic-acid by hydrogenation and electroreduction approaches

MOLECULAR CATALYSIS

ALI S, YASIN G, IQBAL R, HUANG X, SU J, IBRAHEEM S, ZHANG Z, WU XQ, WAHID F, ISMAIL PM, QIAO L, XU H