国家/地区 China（3）
关键词 DENSITY FUNCTIONAL THEORY（4）
出版物
出版时间
机构 SOUTHWEST UN.（3）
作者 ZHANG HP（4）

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

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

Exploring adsorption mechanism of glyphosate on pristine and elemental doped graphene

CHEMICAL PHYSICS LETTERS

LI XP, ZHANG R, DONG FQ, TANG YH, XU L, SUN CH, ZHANG HP