@article{Syarif_2024, title={First principles studies on band structures and density of states of graphite surface oxides}, volume={4}, url={https://oiccpress.com/international-journal-of-nano-dimension/article/first-principles-studies-on-band-structures-and-density-of-states-of-graphite-surface-oxides/}, DOI={10.7508/ijnd.2013.01.007}, abstractNote={Graphite oxide constitutes carbon network with oxygen atoms both on hexagonal arrangement and the edge sites. Structural and electronic properties for graphite-oxygen complexes have been explored using first-principles total-energy calculations within the local density approximation (LDA). Band structures and density of states for the propose carbon 3D models are reported. A finite energy gap and planarity of graphene layer emerges for the oxygen-functionalized graphite, therefore its value varies with the ratio of carbon to oxygen and sites on carbon network.}, number={1}, journal={International Journal of Nano Dimension (Int. J. Nano Dimens.)}, publisher={OICC Press}, author={Syarif, N.}, year={2024}, month={Feb.}, keywords={Density of states, Band Structure, Graphite oxides, Local Density Approximation, First-principles} }