Papers by Author: Arturo I. Martinez

Abstract: Fe2O3 thin films were obtained on glass substrates by the ultrasonic spray pyrolysis technique; additionally, a thermodynamic analysis on the Fe2O3 formation from different precursor salts was performed. In this work, the influence of the deposition temperature is related with the structural, optical, and morphological properties of the iron oxide films. The present results reveal that amorphous thin films are obtained at temperatures lower than 350° C, while polycrystalline films with the maghemite structure are formed at higher temperatures.

Abstract: Density functional theory calculations of hydrogen storage capacity for different organometallic structures have been carried out. Complexes involving Sc, Ti and V bound to C4H4, C5H5, C5F5 and B3N3H6 molecules have been considered, and all present a hydrogen storage capability limited by the 18-electron rule. In order to stabilize the complexes, which the 18-electron rule is not completed, additional ligands are considered, namely -H, -CH3, -NH2, -OH and -F. These ligands affect the H2-metal bond; particularly the back donation effect from the metal atom to the * antibonding state of H2 and then its H2 storage capacity.