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First-principles prediction of the ground-state crystal structure of double-perovskite halides Cs2AgCrX6 (X = Cl, Br, and I)

Muhammad SaeedCollege of Nuclear Science and Engineering, East China University of Technology, Nanchang 330013, People's Republic of ChinaIzaz Ul HaqCenter for Computational Materials Science, Department of Physics, University of Malakand, Chakdara, PakistanAwais Siddique SaleemiCollege of Physics and Optoelectronic Engineering, Shenzhen University, Nanhai Ave. 3688, Shenzhen, Guangdong 518060, People's Republic of ChinaShafiq Ur RehmanCollege of Physics and Optoelectronic Engineering, Shenzhen University, Nanhai Ave. 3688, Shenzhen, Guangdong 518060, People's Republic of ChinaBakhtiar Ul HaqDepartment of Physics, College of Science, King Khalid University, Abha 61413, P.O. Box 9004, Saudi ArabiaAijaz Rasool ChaudhryDepartment of Physics, College of Science, University of Bisha, Bisha 61922, P.O. Box 551, Saudi ArabiaImad KhanCenter for Computational Materials Science, Department of Physics, University of Malakand, Chakdara, Pakistan
2021en
ABI

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