国家/地区 China（3）
关键词 DENSITY FUNCTIONAL THEORY（3）
出版物
出版时间 2022（3）
机构
作者 DAI XQ（3）

Density functional theory study on the adsorption properties of SO2 gas on graphene, N, Ti, and N-Ti doped graphene

MICRO NANOSTRUCTURES

LUO QQ, YIN SQ, SUN XX, TANG YA, FENG Z, DAI XQ

Density functional theory study on the electronic, optical and adsorption properties of Ti-, Fe- and Ni- doped graphene

DIAMOND RELATED MATERIALS

LUO QQ, YIN SQ, SUN XX, TANG YA, FENG Z, DAI XQ

Theoretical insights into the CO/NO oxidation mechanisms on single-atom catalysts anchored H-4,H-4,H-4-graphyne and H-4,H-4,H-4-graphyne/graphene sheets

FUEL

TANG YA, SHI JL, CHEN WG, LI Y, TIAN H, CUI YQ, WANG ZW, FENG Z, DAI XQ