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73 ta ish

Ish: Computational investigation of novel Cs2BSbF6 (B = Ti, In): A promising material for optoelectronic and thermoelectric applications

  1. Necessary and sufficient elastic stability conditions in various crystal systems

    Félix Mouhat, François‐Xavier Coudert

    MaqolaOchiq kirish201419 iqtibos
    ABI

  2. Linear optical properties of solids within the full-potential linearized augmented planewave method

    Claudia Draxl, Jorge O. Sofo

    MaqolaOchiq kirish200618 iqtibos
    ABI

  3. Wave-Number-Dependent Dielectric Function of Semiconductors

    David R. Penn

    Maqola196218 iqtibos
    ABI

  4. Construction of a novel S-scheme CaIn2S4-ZnO/pine cone-derived biochar for enhanced visible-light-induced photocatalytic H2O2 production and antibiotic degradation

    M. Khlifi, Waqed H. Hassan, Abdul Amir H. Kadhum +6

    MaqolaAdvanced Photocatalysis TechniquesJournal of Water Process Engineering202513 iqtibos
    ABI

  5. Fabrication of dual-functional Cs3Bi2I9-WO3 S-scheme heterojunction for photocatalytic H2 production and polluted water treatment: Optimization, mechanism and toxicity evaluation

    Mutairah S. Alshammari, Waqed H. Hassan, Murtadha M. Al-Zahiwat +5

    MaqolaAdvanced Photocatalysis TechniquesJournal of Alloys and Compounds20259 iqtibos
    ABI

  6. Probing of mechanical, optical and thermoelectric characteristics of double perovskites Cs2GeCl/Br6 by DFT method

    Q. Mahmood, Taher Ghrib, Amani Rached +2

    Maqola20209 iqtibos
    ABI

  7. Screening the Structural, Tuning Band Gaps, Optical and Thermal Properties of Inorganic A2AgRhF6 (A = Na, Rb) Double Perovskites Halide Using DFT Calculations

    Muhammad Mahadi Abdul Jamil, Aparna Dixit, Junaid Munir +5

    Maqola20246 iqtibos
    ABI

  8. DFT Analysis of Ba2NbRhO6: A Promising Double Perovskite for Sustainable Energy Applications

    Soufyane Belhachi, Samah Al‐Qaisi, Saidi Samah +7

    Maqola20246 iqtibos
    ABI

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

    Muhammad Saeed, Izaz Ul Haq, Awais Siddique Saleemi +4

    Maqola20215 iqtibos
    ABI

  10. First-principles calculations to investigate electronic, structural, optical, and thermoelectric properties of semiconducting double perovskite Ba2YBiO6

    Samah Al‐Qaisi, Muhammad Mushtaq, Jamila S. Alzahrani +7

    Maqola20225 iqtibos
    ABI

  11. Ruddlesden-Popper compound Sr2TiO4 doped with chalcogens for optoelectronic applications: Insights from first-principle calculations

    Meryem Ziati, Naoual Bekkioui, H. Ez‐Zahraouy

    Maqola20215 iqtibos
    ABI

  12. DFT Insights on the Future Prospects of Ba2PrXO6 (X = Ir, Pt) Double Perovskites for High-Energy Applications

    Nasir Rahman, Khamael M. Abualnaja, Soufyane Belhachi +8

    Maqola20245 iqtibos
    ABI

  13. DFT study of structural, mechanical, and opto-electronic properties of scadium-based halide double perovskite Cs2ScInBr6 for optoelectronic applications

    Suhail A. Dar, Basharat Want

    Maqola20224 iqtibos
    ABI

  14. Chalcogens’ impurities and a single F-center in perovskite SrHfO3 compound: Ab initio calculations

    S. Dahbi, N. Tahiri, O. El Bounagui +1

    Maqola20214 iqtibos
    ABI

  15. Study on pressure-induced band gap modulation and physical properties of direct band gap Ca3NX3 (X = Cl, Br) for optoelectronic and thermoelectric applications

    Maruf Al Yeamin, Asif Hosen, Md. Adil Hossain +6

    Maqola20244 iqtibos
    ABI

  16. First Principles Investigations of Physical Properties of the CsSnI3 Halide Perovskite for Thermophotovoltaics Devices

    Salman Ahmed, Abdul Majid, Mohammad Nasir +8

    Maqola20254 iqtibos
    ABI

  17. Designing a novel Ti3C2 MXene-bridged Z-scheme photocatalyst for effective H2 generation and removal of non-biodegradable norfloxacin: Optimization and mechanism insights

    Haitao Lin, Waqed H. Hassan, Hayder A. Abbood +8

    MaqolaAdvanced Photocatalysis TechniquesJournal of Alloys and Compounds20253 iqtibos
    ABI

  18. DFT based first principles study of novel combinations of perovskite-type hydrides XGaH3 (X = Rb, Cs, Fr) for hydrogen storage applications

    R.M. Arif Khalil, Shafqat Hayat, Muhammad Iqbal Hussain +2

    MaqolaOchiq kirish20213 iqtibos
    ABI

  19. Effects of oxygen group elements on thermodynamic stability, electronic structures and optical properties of the pure and pressed BaTiO3 perovskite

    S. Dahbi, N. Tahiri, O. El Bounagui +1

    Maqola20223 iqtibos
    ABI

  20. Structural, optical, dielectric, and magnetic properties of iron-sillenite Bi25FeO40

    H. Jebari, N. Tahiri, M. Boujnah +4

    Maqola20223 iqtibos
    ABI

  21. DFT-Based Tailoring of the Thermoelectric and Photovoltaic Response of the Halide Double Perovskite Cs2TlYF6 (Y = Ag, Co)

    Ali S. Alshomrany, R. Bousbih, Muhammad Sajid +8

    Maqola20243 iqtibos
    ABI

  22. Tuning of band gap by anions (Cl, Br, I) of double perovskites Rb<sub>2</sub>AgAsX<sub>6</sub> (Cl, Br, I) for solar cells and thermoelectric applications

    Ghazanfar Nazir, Q. Mahmood, M. Hassan +6

    Maqola20222 iqtibos
    ABI

  23. Optical properties of SiC nanosheet

    M. Houmad, O. Dakir, A. Abbassi +3

    Maqola20152 iqtibos
    ABI

  24. Halide double perovskite Cs2AgInBr6 for photovoltaic’s applications: Optical properties and stability

    Adel Menedjhi, N. Bouarissa, S. Saib +1

    Maqola20212 iqtibos
    ABI

  25. Elastic and thermodynamic properties of new (Zr3−Ti )AlC2 MAX-phase solid solutions

    M.A. Hadi, M. Roknuzzaman, A. Chroneos +4

    MaqolaOchiq kirish20172 iqtibos
    ABI