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First-principles predictions of structure, half-metallic antiferromagnetism, optoelectronic, and elastic properties of double perovskites A2TaNiO6 (A = Ca, Sr, and Ba) for energy harvesting

H. Saad Ali, G. Murtaza, Ahmad Ayyaz, Khawar Ismail, Maryam Touqir, Hafeez Ur Rehman, Yousef Mohammed Alanazi

2024Materials Science in Semiconductor Processing23 citationsDOI

Topics & Concepts

Materials scienceAntiferromagnetismMetalCondensed matter physicsOptoelectronicsMetallurgyPhysicsPerovskite Materials and ApplicationsFerroelectric and Piezoelectric MaterialsAdvanced Thermoelectric Materials and Devices
First-principles predictions of structure, half-metallic antiferromagnetism, optoelectronic, and elastic properties of double perovskites A2TaNiO6 (A = Ca, Sr, and Ba) for energy harvesting | Litcius