A Comparative DFT Investigation on the Structural, Electric, Thermodynamic, and Optical Properties of the Pristine and Various Metals and Nonmetals (Li, Be, B, N, O, and F) Doped Graphene and Silicene Nanosheets
Aoly Ur Rahman, Budrun Neher, Sazzad Hossain, Md. Mahbubur Rahman Bhuiyan, D. M. Saaduzzaman, Syed Mahedi Hasan, Md. Kabir Uddin Sikder
Topics & Concepts
SiliceneGrapheneMaterials scienceDensity functional theoryDopingDopantNanotechnologySupercapacitorChemical physicsOptoelectronicsComputational chemistryPhysical chemistryCapacitanceElectrodeChemistryGraphene research and applications2D Materials and ApplicationsMXene and MAX Phase Materials