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Zirconium-based cubic-perovskite materials for photocatalytic solar cell applications: a DFT study

Muhammad Khuram ShahzadCenter of Theoretical and Computational Research, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanSyed Taqveem MujtabaDepartment of Physics, Riphah International University, Faisalabad Campus, Faisalabad, PakistanShoukat HussainCenter of Theoretical and Computational Research, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanJalil Ur RehmanCenter of Theoretical and Computational Research, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanMuhammad Umair FarooqInstitute of Physics, The Islamia University of Bahawalpur, 63100 PakistanMuhammad Aslam KhanCenter of Theoretical and Computational Research, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanMuhammad Bilal TahirCenter of Theoretical and Computational Research, Khwaja Fareed University of Engineering and Information Technology, Rahim Yar Khan, PakistanMuhammad Mahmood AliCentre for Mathematical Modeling and Intelligent Systems for Health and Environment (MISHE), Atlantic Technological University Sligo, Ash Lane, F91 YW50 Sligo, Ireland
2022en
ABI

Annotatsiya

The structural, electronic, optical, and mechanical characteristics of cubic inorganic perovskites XZrO 3 (X = Rb and K) were studied using the Cambridge serial total energy package-based DFT.

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