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RESEARCH PAPER · MATEC Web of Conferences · 2023

Computational studies on magnesium spinel’s [MgY2S4 and MgY2Se4]

Khumbulani Tibane, Phuti Esrom Ngoepe, Cliffton Masedi

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Computational studies on magnesium spinel’s [MgY2S4 and MgY2Se4]OriginalInvestigation of Elastic and Thermodynamic Properties of XA2B4 (X = Mg, Zn, Cd; A = Sc, Y; B = S, Se) Spinel Compounds2Investigation of the electronic, optical and thermoelectric properties of MgA2B4 (A = Sc, Y; B = S, Se) compounds by using density functional theory under strain effect0The structural, elastic, electronic, optical, thermodynamic, and phonon properties of MgX2Se4 (X=Er, Ho, Tm, Y) spinel compounds0Pressure induced bandgap variation for the optical and photo-catalytic properties of MgA2X4 (A = Sc, Y; X = S, Se) spinel compounds0

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  1. Investigation of Elastic and Thermodynamic Properties of XA2B4 (X = Mg, Zn, Cd; A = Sc, Y; B = S, Se) Spinel Compounds

    Acta Physica Polonica A · 2025-09-04

    Zubaida Noor, Ghulam Murtaza, Muhammad Awais Jehangir, Aijaz Rasool Chaudhry

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  2. Investigation of the electronic, optical and thermoelectric properties of MgA2B4 (A = Sc, Y; B = S, Se) compounds by using density functional theory under strain effect

    Radiation Physics and Chemistry · 2026-04-18

    Ubaid Ur Rahman, Ahmed B. M. Ibrahim, M. Habib M. Habib, Khalid I. Anojaidi, Waleed A. Al-Suwaylih, Mohamemd A. Al‐Suwaylih, Shamim Khan, G. Murtaza

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  3. The structural, elastic, electronic, optical, thermodynamic, and phonon properties of MgX2Se4 (X=Er, Ho, Tm, Y) spinel compounds

    Computational Condensed Matter · 2026-07-03

    Sehergül Akçay, Hüsnü Koc, Şevket Şimşek, Amirullah M. Mamedov, Ekmel Özbay

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  4. Pressure induced bandgap variation for the optical and photo-catalytic properties of MgA2X4 (A = Sc, Y; X = S, Se) spinel compounds

    Pramana · 2026-09-02

    Zubaida Noor, G. Murtaza, Muhammad Awais Jehangir, Aijaz Rasool Chaudhry, Aurangzeb

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