国家/地区 Pakistan（2）
关键词 DFT（2）
出版物 JOURNAL OF MOLECULAR GRAPHICS MODELLING（2）
出版时间 2021（2）
机构
作者

A comparative density functional theory study of oxygen doping versus adsorption on graphene to tune its band gap

JOURNAL OF MOLECULAR GRAPHICS MODELLING

HUSSAIN A, BASIT A

Surface functionalization of twisted graphene C32H15 and C104H52 derivatives with alkalis and superalkalis for NLO response; a DFT study

JOURNAL OF MOLECULAR GRAPHICS MODELLING

KOSAR N, AYUB K, MAHMOOD T