国家/地区 China（9）
关键词 DENSITY FUNCTIONAL .（3） DFT（3） GRAPHENE（3）
出版物 APPLIED SURFACE SCI.（3）
出版时间 2015（4） 2013（2） 2014（2）
机构 SOUTHWEST UNIV SCI TECHNOL（9）
作者 LIN XY（9）

DFT study of adsorption and dissociation behavior of H2S on Fe-doped graphene

APPLIED SURFACE SCIENCE

ZHANG HP, LUO XG, SONG HT, LIN XY, LU X, TANG YH

Adsorption of 2,3,7,8-tetrochlorodibenzo-p-dioxins on intrinsic, defected, and Ti (N, Ag) doped graphene: a DFT study

JOURNAL OF MOLECULAR MODELING

ZHANG HP, HE WD, LUO XG, LIN XY, LU X

Density functional theory calculations of hydrogen adsorption on Ti-, Zn-, Zr-, Al-, and N-doped and intrinsic graphene sheets

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

ZHANG HP, LUO XG, LIN XY, LU X, LENG Y

Density functional theory calculations on the adsorption of formaldehyde and other harmful gases on pure, Ti-doped, or N-doped graphene sheets

APPLIED SURFACE SCIENCE

ZHANG HP, LUO XG, LIN XY, LU X, LENG Y, SONG HT

The molecular understanding of interfacial interactions of functionalized graphene and chitosan

APPLIED SURFACE SCIENCE

ZHANG HP, LUO XG, LIN XY, LU X, TANG YH

SUPER-PARAMAGNETIC NANOPARTICLES BY SURFACE IMPRINTING ON GRAPHENE OXIDE MODIFIED IRON(II, III) WITH APPLICATION FOR THE DETERMINATION OF OVALBUMIN BY ABSORPTION SPECTROSCOPY

ANALYTICAL LETTERS

TANG PP, ZHANG HP, HUO JC, LIN XY

Band structure of graphene modulated by Ti or N dopants and applications in gas sensoring

JOURNAL OF MOLECULAR GRAPHICS MODELLING

ZHANG HP, LUO XG, LIN XY, ZHANG YP, TANG PP, LU X, TANG YH

Modulating the interactions between MgH2 and graphene using different dopants

CHEMICAL PHYSICS LETTERS

ZHANG HP, LUO XG, LIN XY, TANG PP, LU X, FANG LM, TANG YH

An electrochemical sensor based on iron(II,III) @graphene oxide@molecularly imprinted polymer nanoparticles for interleukin-8 detection in saliva

ANALYTICAL METHODS

TANG PP, ZHANG HP, HUO JC, LIN XY