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

The interaction of hyaluronic acid and graphene tuned by functional groups: A density functional study

COMPUTATIONAL THEORETICAL CHEMISTRY

WANG Q, SHE WQ, LU X, LI PF, SUN YX, LIU XD, PAN WH, DUAN K

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