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Thermally stable Pb-free BaHfSe3 chalcogenide perovskite: a DFT and AIMD study of optoelectronic and thermoelectric properties
Diyar Sadiq, Nawzad A Abdulkareem, Hameed T Abdulla, Mohammed Noor S Rammoo
Communications in Theoretical Physics . 2026, (10): 105702 .  DOI: 10.1088/1572-9494/ae84fd