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Nanoscale ab-initio calculations of optical and electronic properties of LaCrO3 in cubic and rhombohedral phases
Year: 2009
Abstract:
We report nanoscale ab-initio calculations of the linear optical and electronic properties of LaCrO3 in nonmagnetic cubic and rhombohedral phases using the full potential linear augmented plane wave (FP-LAPW) method. In this work the generalized...