Now showing items 1-2 of 2

    • Chemically uracil-functionalized carbon and silicon carbide nanotubes: computational studies 

      Harismah, K.; Mirzaei, M.; Sahebi, H.; Gülseren, O.; Rad, A. S. (Elsevier, 2018)
      Chemical additions of uracil (U) nucleobase to sidewall of each of representative (4,4) armchair carbon and silicon carbide nanotubes (CNT and SiCNT) were investigated based on density functional theory (DFT) calculations. ...
    • DFT studies of CNT-functionalized uracil-acetate hybrids 

      Mirzaei, M.; Gulseren, O. (Elsevier, 2015)
      Calculations based on density functional theory (DFT) have been performed to investigate the stabilities and properties of hybrid structures consisting of a molecular carbon nanotube (CNT) and uracil acetate (UA) counterparts. ...