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Novel green phosphorene sheets to detect tear gas molecules - A DFT insight

R. Bhuvaneswari, V. Nagarajan, R. Chandiramouli

2020Journal of Molecular Graphics and Modelling27 citationsDOI

Topics & Concepts

PhosphoreneNanosheetDensity functional theoryMoleculeMaterials scienceAdsorptionBand gapChemical physicsNanotechnologyComputational chemistryChemistryOptoelectronicsPhysical chemistryOrganic chemistry2D Materials and ApplicationsPerovskite Materials and ApplicationsMXene and MAX Phase Materials
Novel green phosphorene sheets to detect tear gas molecules - A DFT insight | Litcius