[PDF][PDF] The Hydrogen and Sulfur Surfaces Effect on the Structural and Electronic Properties of Graphene Nano Ribbon
SR Salman, HB Hassan… - Journal of Global Pharma …, 2018 - researchgate.net
Present work deals with the effect of hydrogen and sulfur surfaces on the structural and
electronic properties of grapheme nano-ribbon using the B3LYP/DFT with 6-31G basis sets …
electronic properties of grapheme nano-ribbon using the B3LYP/DFT with 6-31G basis sets …
Thermoelectric properties of platinum metal complexes
MK Al-Khaykanee, FA Al-Temimei… - AIP Conference …, 2019 - pubs.aip.org
DFT method was used to investigate the conductivities and thermoelectric properties for
platinum metal complexes. The results were showed the type of ligands in the molecular …
platinum metal complexes. The results were showed the type of ligands in the molecular …
[PDF][PDF] Theoretical Study of Electronic and Electrical Properties of Pure and Doped Graphene Sheets
The studied graphene sheets were design at Gaussian View 5.0. 8 program and initially
relaxed at Gaussian 09 program. The last relaxation of these structures was done using the …
relaxed at Gaussian 09 program. The last relaxation of these structures was done using the …
Study of Electronic Properties and UV-Vis Spectrum of a Single Molecule as Molecular Electronics
Current study deals with electronic properties and absorption spectrum calculations for a
single molecule. The calculations were done based on the theory of density function DF. Our …
single molecule. The calculations were done based on the theory of density function DF. Our …