Papers by Keyword: Organic-Inorganic Hybrid Compound

Abstract: Thin films of organic-inorganic hybrids (CnH2n+1NH3)2PbX4(X=Cl, Br, I; n=4,6,8,10) were prepared by the spin-coating method. The influences of annealing temperature on the crystal structure of the films were analyzed by X-ray diffraction(XRD). The surface morphology of the films were observed using scanning electronic microscope(SEM). The room-temperature UV-Vis absorption spectra of the films were employed to examine the effect on the optical properties of different elements X (X=Cl,Br,I), and varying n from 4 to 10, respectively. The results showed that a significant red shift of the absorption peak was observed for different X in inorganic layers, and the position of the exciton absorption peaks did not shift obviously with the increasing of the alkyl chain length in organic layers. The results suggested that the exciton absorption arise from electronic transitions within the inorganic layer, rather than from the organic layer.

Abstract: The organic-inorganic hybrid compounds have attracted much attention for their interesting structures and various properties. In present work, we concentrated on the band structures of the hybrid compound (C4H9NH3)2GeI4 and tried to find out the relations between the geometry structure and the properties. The hybrid’s primitive cell was large and including too many atoms, so it was difficult to have a direct and clear analysis on the band structure. The hybrids’ DOS and PDOS were analyzed instead, as it was another effective way to analyze the band structure of the hybrid especially when the band structure was complicated. The model of (C4H9NH3)2GeI4 was set up, and the program based on the first principle had been employed to calculate its band structure. The difference of iodine’s PDOS caused by structure was also discussed.