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RESEARCH PAPER · Results in Materials · 2025

Modulating physical properties of ASnF3 (A = K, Rb) perovskites under pressure: Insights for enhanced optoelectronic performance via first-principles

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Modulating physical properties of ASnF3 (A = K, Rb) perovskites under pressure: Insights for enhanced optoelectronic performance via first-principlesOriginalExploring the influence of hydrostatic pressure on the structural, mechanical, and optoelectronic behavior of AlSnBr3 and AlSnI3 halide perovskites via DFT1First-principles investigation of the structural, electronic, and optical properties of the novel fluoroperovskite FrHgF₃ for optoelectronic and photovoltaic applications0Half-metallic halide perovskites BaSnX3 (X = F, Cl): A first-principles study of spin-polarized electronic, optical, and thermodynamic properties2Enhancing hydrogen storage characteristics of novel XV3H8 (X = Ca, Sr, Ba) hydride by A-site cation substitution: Insights from first-principles study1Prominent ductile entity, enhanced ultraviolet absorption, and tunable band gap of LiXF3 (X = Si, Ge, Sn and Pb) fluoroperovskites: A comprehensive DFT insights0

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  1. Exploring the influence of hydrostatic pressure on the structural, mechanical, and optoelectronic behavior of AlSnBr3 and AlSnI3 halide perovskites via DFT

    Chemical Physics · 2025-12-13

    Youssef Jouad, Younes Ziat, Abdellah Bouzaid, Mohammed Miri, Hamza Belkhanchi, Zakaryaa Zarhri

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  2. First-principles investigation of the structural, electronic, and optical properties of the novel fluoroperovskite FrHgF₃ for optoelectronic and photovoltaic applications

    Materials Today Communications · 2026-01-01

    Laila El haidami, Mohammed Afsi, A. Lemziouka, rachid ahfir, H. Lemziouka, E.K. Hlil, Lamiae Mrharrab

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  3. Half-metallic halide perovskites BaSnX3 (X = F, Cl): A first-principles study of spin-polarized electronic, optical, and thermodynamic properties

    Journal of materials research/Pratt's guide to venture capital sources · 2026-02-26

    Alae Ragaoui, Soukaina Dahri, A. Jabar, L. Bahmad, L.B. Drissi, R. Ahl Laamara

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  4. Enhancing hydrogen storage characteristics of novel XV3H8 (X = Ca, Sr, Ba) hydride by A-site cation substitution: Insights from first-principles study

    Chinese Journal of Physics · 2026-03-10

    Jahid Kabir Rony, Md Saiduzzaman, Ayman A. Aly, Alsharef Mohammad, Ankur Chowdhury, Omar Alsalmi, Mohd Taukeer Khan, Dongjin Choi, Noureddine Ali Elboughdiri

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  5. Prominent ductile entity, enhanced ultraviolet absorption, and tunable band gap of LiXF3 (X = Si, Ge, Sn and Pb) fluoroperovskites: A comprehensive DFT insights

    Physica B Condensed Matter · 2026-07-30

    Abdur Rahman, Jakiul Islam, Sujat Hossen

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