Structural characterization and electron density distribution studies of (La0.8Ca0.2)(Cr0.9−xCo0.1Mnx)O3

Abstract

The doped lanthanum chromite (La0.8Ca0.2)(Cr0.9−xCo0.1Mnx)O3 (x=0.03, 0.06, 0.09 and 0.12) were synthesized by solid state reaction technique. The samples have been characterized by X-ray diffraction for structural and charge density analysis. XRD data show that the grown samples are orthorhombic in structure with single phase. The spatial charge density distribution in the unit cell for the synthesized samples has been studied using maximum entropy method. Further, the samples were analyzed by UV–visible spectrometry for optical properties and scanning electron microscopy for surface morphology. From the optical data, it was found that the direct band gap of the samples range from 2.27 to 2.46eV. The samples were also investigated by vibrating sample magnetometry for magnetic properties. From VSM data, it is inferred that all the samples in this series are found to be predominantly antiferromagnetic in nature. Since the doped lanthanum chromites have good mechanical properties and electrical conductivity at high temperature, these materials are used in solid oxide fuel cells (SOFC).