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Theoretical prediction of perovskite ARH3 (A = K, Li, Rb; R Ca, Sr) hydride materials for hydrogen storage applications: A DFT investigation

Yi SongIndustrial Engineering and Operations Research Department, Columbia University, 500 W. 120th Street, New York, NY, 10027, USAMuhammad Khuram ShahzadInstitute of Physics, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, 64200, PakistanShoukat HussainInstitute of Physics, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, 64200, PakistanAftab FarrukhDepartment of Physics, PMAS-Arid Agriculture University, Rawalpindi, 46300, PakistanMuhammad RiazInstitute of Physics, The Islamia University of Bahawalpur, Bahawalpur, 63100, PakistanHarse SattarSchool of Integrated Circuits, Huazhong University of Science and Technology, ChinaGul N. KhanFaculty of Transport and Aviation Engineering Silesian University of Technology, Katowice, 40-019, PolandGhulam Abbas AshrafNew Uzbekistan University, Mustaqillik Ave.54, Tashkent, 100007, UzbekistanSyed Mansoor AliDepartment of Physics and Astronomy, College of Science, P.O. BOX 2455, King Saud University, Riyadh, 11451, Saudi ArabiaManawwer AlamDepartment of Chemistry, College of Science, P.O. BOX 2455, King Saud University, Riyadh, 11451, Saudi Arabia
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