国家/地区 China（6）
关键词 DENSITY FUNCTIONAL THEORY（6）
出版物 MOLECULAR CATALYSIS（2）
出版时间 2019（6）
机构 NORTH CHINA ELECT POWER UNIV（6）
作者 GAO ZY（5） LIU XS（5） YANG WJ（5） LI A（4）
LI X（4） DING XL（3） MA CZ（3） YANG JM（2）

The adsorption and activation of oxygen molecule on nickel clusters doped graphene-based support by DFT

MOLECULAR CATALYSIS

GAO ZY, LI A, LI X, LIU XS, MA CZ, YANG JM, YANG WJ, LI H

DFT Study of N2O Adsorption onto the Surface of M-Decorated Graphene Oxide (M = Mg, Cu or Ag)

MATERIALS

LIU Z, CHENG XR, YANG YM, JIA HZ, BAI BQ, ZHAO L

Adsorption behavior of Pt embedded on N-doped graphene sheets toward NO and NH3 molecules

APPLIED ORGANOMETALLIC CHEMISTRY

GAO ZY, LI X, LI A, MA CZ, LIU XS, YANG JM, YANG WJ

Density functional study of the adsorption of NO on Ni-n (n=1, 2, 3 and 4) clusters doped functionalized graphene support

APPLIED SURFACE SCIENCE

GAO ZY, LI A, LIU XS, MA CZ, LI X, YANG WJ, DING XL

Bimetallic sites supported on N-doped graphene ((Fe,Co)/N-GN) as a new catalyst for NO oxidation: A theoretical investigation

MOLECULAR CATALYSIS

GAO ZY, LIU XS, LI A, LI X, DING XL, YANG WJ

The adsorption characteristics of As2O3, Pb-0, PbO and PbCl2 on single atom iron adsorbent with graphene-based substrates

CHEMICAL ENGINEERING JOURNAL

YANG WJ, GAO ZY, LIU XS, DING XL, YAN WP