Two-dimensional FePc and MnPc monolayers as promising materials for SF6 decomposition gases detection: Insights from DFT calculations
Zhifeng Nie, Chen Wang, Rou Xue, Gang Xie, Huihui Xiong
Topics & Concepts
MonolayerSulfur hexafluorideAdsorptionDensity functional theoryMoleculeChemical physicsCharge densityMaterials scienceDecompositionChemistryComputational chemistryPhysical chemistryNanotechnologyOrganic chemistryPhysicsQuantum mechanics2D Materials and ApplicationsGas Sensing Nanomaterials and SensorsGraphene research and applications