Litcius/Paper detail

Interaction studies of propylene and butadiene on tricycle graphane nanosheet – A DFT outlook

V. Nagarajan, R. Bhuvaneswari, R. Chandiramouli

2023Journal of Molecular Graphics and Modelling22 citationsDOI

Topics & Concepts

GraphaneNanosheetMaterials scienceDensity functional theoryBand gapPopulationChemistryComputational chemistryChemical physicsNanotechnologyOptoelectronicsSociologyDemographyGraphene research and applicationsCarbon Nanotubes in Composites2D Materials and Applications