Recently, graphene and modified graphene as one of the most suitable and the most important carbon nanomaterials have been introduced for drug delivery. In this paper, we have studied the binding characteristics of the EDC-NHS cross-linking process of graphene-phenyl-NH2 and 5-aminolevulinic acid (ALA) drug in both gas and solvent phases by density functional theory calculations. For describing binding properties and reaction nature between graphene-ghenyl-NH2 and ALA drug, quantum molecular descriptors, topological analysis, natural bond orbital analysis, analysis of the bond order, the density of states, and analysis bond length was investigated in solvent and gas phases. Due to the results, the complex of the graphene-phenyl-NH2 @ALA turns to absorb more electrons in water solvent than gas phase. Furthermore, the binding of graphene-phenyl-NH2 and ALA is mainly based on covalent interactions, and bond order of graphene-phenyl-NH2 @ALA complex is one in solvent and gas phases. The praphene-phenyl- NH2 @ALA complex has displayed a meaningful improvement of electronic and structural properties. Therefore, it represented that praphene-phenyl-NH2 being combined with the ALA drug is appropriate for use in drug delivery.

In this work, pure and Alumina doped cobalt ferrite nanoparticles CoFe2−xAlxO4 (for x = 0.44) have been synthesized by the sol gel method. The influence of alumina doping on the morphological and mechanical properties of CoFe2O4 nano-particles were investigated by means of X-ray powder diffraction (XRD) and rietveld analysis. XRD analysis confirmed that the single phase formation of pure nano particles with the expected cubic inverse spinel structure with Fd3m space group and without any impurity phase. Alumina doping were led to a decrease in the crystallite size, lattice parameter, elastic constants and magnitude of moduli. It is explained on the basis of the replacement of Fe ions with half-filled d-shell (3d5) and larger radius by Al3+ ions with a completely filled shell (2p6) and smaller radius.

In the present work, the Co/TiO2 nanocomposite was prepared by sol-gel method. The structural and optical properties of nanocomposite were studied using, X-ray diffraction (XRD) and diffuse reflectance UV-VIS spectrometry. The XRD spectra revealed its tetrahedral anatase structure. The grain size and optical properties of composite are also reported. Syntesied Co/TiO2photocatalyst showed excellent activity for the photodegradation of Methyl orange whether under visible and ultraviolet light irradiation.