Se掺杂对单层MoS2电子能带结构和光吸收性质的影响
李刚,陈敏强,赵世雄,李朋伟,胡杰,桑胜波,侯静静

Effect of Se Doping on the Electronic Band Structure and Optical Absorption Properties of Single Layer MoS2
Gang LI,Min-Qiang CHEN,Shi-Xiong ZHAO,Peng-Wei LI,Jie HU,Sheng-Bo SANG,Jing-Jing HOU
图4 采用PBE方法计算的Se掺杂单层MoS2的能带结构图
Fig 4 Band structure of Se-doped monolayer MoS2 calculated by PBE methods The vacuum level is taken as zero reference. PBE: Predew-Burke-Ernzerhof