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Published in 2023 at "Journal of computational chemistry"
DOI: 10.1002/jcc.27119
Abstract: In this study, structural, electronic, optical, thermoelectric, and thermodynamics properties of vacancy‐ordered double perovskites Rb2XCl6 (X = Se, Ti) were explored theoretically. The results revealed that Rb2SeCl6 and Rb2TiCl6 are indirect band gap (Eg) semiconductors with Eg…
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Keywords:
lead free;
investigation lead;
thermoelectric;
double perovskites ... See more keywords