Structural, electronic and optical properties of CdGeAs2 with hybrid density functional (HSE06)
Mengqiu Yu, Xiao Xiao, Zhengbin Xiong, Jiaxi Li, Xinyao Liu, Wei Huang, Baojun Chen, Z. Y. He
Topics & Concepts
Hybrid functionalMaterials scienceBand gapSemiconductorElectronic structureDensity functional theoryElectronic band structureCharge (physics)Condensed matter physicsChemical physicsOptoelectronicsComputational chemistryPhysicsQuantum mechanicsChemistryChalcogenide Semiconductor Thin FilmsQuantum Dots Synthesis And PropertiesSemiconductor materials and interfaces