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Ish: Insight into structural, electronic, optical and elastic properties of double perovskites Rb2XCrCl6 (X= K, Na) via DFT study

  1. Electronic Structural, Optical and Elastic Properties of K-Based Lead-Free Perovskites KXF3 (X = Nb, Ti, Zr) via DFT Computational Approach

    Jehan Y. Al‐Humaidi, Abdullah Abdullah, Amina +7

    MaqolaPerovskite Materials and ApplicationsJournal of Inorganic and Organometallic Polymers and Materials20234 iqtibos
    ABI

  2. Study of structural, electronic, optical and mechanical properties of K2ScCuF6 and K2YCuF6 perovskites via DFT calculations

    Amina, Muhammad Uzair, Amir Sohail Khan +10

    MaqolaHeusler alloys: electronic and magnetic propertiesResults in Physics20242 iqtibos
    ABI

  3. Structural, Electronic and Optical Properties of Altermagnet Bulk <scp>MnBr<sub>2</sub></scp>

    Ghaferah H. Al‐Hazmi, Abid Zaman, Naseem Akhter +7

    MaqolaHeusler alloys: electronic and magnetic propertiesInternational Journal of Quantum Chemistry20252 iqtibos
    ABI

  4. Structural, electronic, mechanical, optical and thermoelectric properties of double perovskites A2CuAlCl6 (A=Cs, Rb, K) with direct bandgap using DFT study

    Tasawer Shahzad Ahmad, Nimra Ehsan, S. M. Sohail Gilani +9

    MaqolaPerovskite Materials and ApplicationsMaterials Chemistry and Physics20251 iqtibos
    ABI

  5. Structural, electronic, magnetic, optical and thermoelectric properties of ferromagnetic double perovskites K2ScCoX6 (X = F, Cl): A first-principles study

    Vineet Tirth, Amina, Muhammad Kamran +11

    MaqolaHeusler alloys: electronic and magnetic propertiesCase Studies in Thermal Engineering20240 iqtibos
    ABI

  6. Elucidating the multifunctional properties of double perovskite hydrides X2MnTlH6 (X = Na, K): A DFT study of half-metallicity, magnetism, hydrogen storage, and optical properties

    Muawya Elhadi, Kakul Husain, Abid Zaman +8

    MaqolaPerovskite Materials and ApplicationsInorganic Chemistry Communications20250 iqtibos
    ABI

  7. First-Principles Investigation of Structural, Electronic, Mechanical and Optical Properties of Tl Based Semiconducting Perovskites TlVX3 (X = Br, I) for Reflective Coating Applications

    Amina, Kakul Husain, Salhah Hamed Alrefaee +9

    MaqolaPerovskite Materials and ApplicationsJournal of Inorganic and Organometallic Polymers and Materials20250 iqtibos
    ABI

  8. Fluoride‐Based Halide Double Perovskites X <sub>2</sub> BiAuF <sub>6</sub> (X = K, Rb): A Computational Insight into their Structural Integrity, Optoelectronic Performance, and Thermoelectric Potential

    Faouzi Didi, Hussain J. Alathlawi, Karrar Hazim Salem +6

    MaqolaHeusler alloys: electronic and magnetic propertiesEnergy Technology20250 iqtibos
    ABI