First-principal investigations of electronic, structural, elastic and optical properties of the fluoroperovskite TlLF3 (L = Ca, Cd) compounds for optoelectronic applications
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DOI: 10.1039/d2ra00464j
Abstract: In this research work, the Tl-based fluoroperovskite compounds TlLF3 (L = Ca, Cd) were investigated computationally using density functional theory (DFT) to comprehend their structural, elastic, optical, and electronic properties. Computation of the tolerance factor… read more here.
Keywords: structural elastic; first principal; principal investigations; investigations electronic ... See more keywords