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A DFT study to investigate physical properties and hydrogen storage capability of Mn-based hydride perovskites XMnH3 (X = Ba, Ca) for hydrogen storage application

Nimra GhaffarCenter for Theoretical and Computational Research (CTCR), Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanMuhammad UsmanDepartment of Applied Mechanics, School of Mathematics and Physics, University of Science and Technology Beijing, Beijing 100083, People’s Republic of ChinaJalil Ur RehmanCenter for Theoretical and Computational Research (CTCR), Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanAltaf HussainInstitute of Physics, Islamia University of Bahawalpur, Bahawalpur, PakistanSyed Mansoor AliDepartment of Physics and Astronomy, College of Science, P.O. BOX 2455, King Saud University, Riyadh 11451, Saudi ArabiaMubasher AliSchool of Engineering and Digital Arts, University of Kent, Canterbury, United Kingdom
2024en
ABI

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