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Autor:
Noor Al-Huda Al-Aaraji, Mohammed Ali Yaseen, Hussien A. Madlol, Hamid I. Abbood, Hayder M. Abduljalil, Mohammed A. Al-Seady, Eman Ahmed
Publikováno v:
IOP Conference Series: Earth and Environmental Science. 1088:012013
In the present study, the density function theory (DFT) method was used to compute structural, electronic and spectroscopic properties for pure and aluminum (Al) doped graphene materials, 6-13G basis set and hybrid function B3LYP were used in the pre