Ti, Ni, and Cu decorated borospherene as potential molecular sensor for phosgene
Kamal A. Soliman, S. Abdel Aal
Topics & Concepts
PhosgeneNatural bond orbitalMaterials scienceDensity functional theoryDipoleChemical physicsMolecular orbitalAdsorptionReactivity (psychology)HOMO/LUMOAtomic physicsMoleculePhysical chemistryComputational chemistryChemistryPhysicsOrganic chemistryAlternative medicineMedicinePathologyMolecular Junctions and NanostructuresBoron and Carbon Nanomaterials Research2D Materials and Applications