国家/地区
关键词 DENSITY FUNCTIONAL THEORY（2）
出版物 JOURNAL OF MOLECULAR MODELING（2）
出版时间 2022（2）
机构
作者

Enhancement of NLO properties of supersalt (Al(BH4)(3))-doped graphene: a DFT study

JOURNAL OF MOLECULAR MODELING

HUMERA, BHATTI IA, MOHSIN M, AMJAD N, SHEHZAD RA, AYUB K, IQBAL J, TAHA TA

A density functional theory study on the adsorption reaction mechanism of double CO2 on the surface of graphene defects

JOURNAL OF MOLECULAR MODELING

ZHANG SJ, LIANG Z, LI KJ, ZHANG JL, REN S