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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

2022Applied Surface Science101 citationsDOI

Topics & Concepts

MonolayerSulfur hexafluorideAdsorptionDensity functional theoryMoleculeChemical physicsCharge densityMaterials scienceDecompositionChemistryComputational chemistryPhysical chemistryNanotechnologyOrganic chemistryPhysicsQuantum mechanics2D Materials and ApplicationsGas Sensing Nanomaterials and SensorsGraphene research and applications
Two-dimensional FePc and MnPc monolayers as promising materials for SF6 decomposition gases detection: Insights from DFT calculations | Litcius