国家/地区 China（4）
关键词 DFT（2）
出版物
出版时间 2019（2） 2020（2）
机构 HUANGGANG NORMAL UNIV（4）
作者 YANG SL（4）

A DFT study of the selective adsorption of XO2 (X = C, S or N) on Ta-doped graphene

COMPUTATIONAL THEORETICAL CHEMISTRY

WANG N, YANG SL, LAN ZG, XU HX, WANG Z, HU YM, GU HS

A DFT study of the enhanced hydrogen storage performance of the Li-decorated graphene nanoribbons

VACUUM

ZHENG N, YANG SL, XU HX, LAN ZG, WANG Z, GU HS

Enhanced hydrogen storage performance of graphene nanoflakes doped with Cr atoms: a DFT study

RSC ADVANCES

XIANG CQ, LI A, YANG SL, LAN ZG, XIE W, TANG YM, XU HX, WANG Z, GU HS

A DFT study of CO adsorption on the pristine, defective, In-doped and Sb-doped graphene and the effect of applied electric field

APPLIED SURFACE SCIENCE

YANG SL, LEI G, XU HX, XU B, LI HP, LAN ZG, WANG Z, GU HS