DFT study of Cun (n = 1–3) cluster-modified WSe2 monolayers for the detection of SF6 decomposition gases (H2S, SO2, SOF2 and SO2F2)
Haoming Zhang, Ziwen Huang, Jiaming Jiang, Wen Zeng, Qu Zhou
Topics & Concepts
Cluster (spacecraft)Materials scienceDesorptionAdsorptionMonolayerDopingCopperDensity functional theoryAtomic physicsChemical physicsPhysical chemistryComputational chemistryNanotechnologyChemistryPhysicsOptoelectronicsMetallurgyProgramming languageComputer science2D Materials and ApplicationsGas Sensing Nanomaterials and SensorsMXene and MAX Phase Materials