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Ab Initio Study of TEPA Adsorption on Pristine, Al and Si Doped Carbon and Boron Nitride Nanotubes

Mir Saleh Hoseininezhad-Namin, Parinaz Pargolghasemi, M. Fahandezh Saadi, Mohammad Ramezani Taghartapeh, Nafiseh Abdolahi, Alireza Soltani, Andrew Ng Kay Lup

2020Journal of Inorganic and Organometallic Polymers and Materials30 citationsDOI

Topics & Concepts

Materials scienceDensity functional theoryBoron nitrideAdsorptionDopingAb initioComputational chemistryCarbon nanotubeBasis setMoleculeNanotechnologyChemical engineeringChemical physicsPhysical chemistryOrganic chemistryChemistryOptoelectronicsEngineeringBoron and Carbon Nanomaterials ResearchFullerene Chemistry and ApplicationsCarbon Nanotubes in Composites
Ab Initio Study of TEPA Adsorption on Pristine, Al and Si Doped Carbon and Boron Nitride Nanotubes | Litcius