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7 works

Work: A DFT investigation of mechanical, optical and thermoelectric properties of double perovskites K2AgAsX6 (X = Cl, Br) halides

  1. A Comprehensive DFT Analysis of Novel Vacancy-Ordered Double Perovskites Na2SnX6 (X = Br, I) for the Opto-electronic and Thermoelectric Properties Applications

    Anjali Kumari, Ali B.M. Ali, Jisha Annie Abraham +5

    ArticlePerovskite Materials and ApplicationsJournal of Inorganic and Organometallic Polymers and Materials20251 citations
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  2. Probing the physical properties of novel lead-free double perovskites A<sub>2</sub>NaAsCl<sub>6</sub> (A = K and Rb): a first-principles approach

    Nazia Erum, Ramesh Sharma, Abhinav Kumar +3

    ArticlePerovskite Materials and ApplicationsNew Journal of Chemistry20251 citations
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  3. First principles insight into Cs<sub>2</sub>YZnX<sub>6</sub> (X = Br, I) double perovskite materials for optoelectronic and thermoelectric device applications

    Abid Zaman, Salhah Hamed Alrefaee, Muawya Elhadi +8

    ArticlePerovskite Materials and ApplicationsPhysical Chemistry Chemical Physics20251 citations
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  4. 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

    ArticleHeusler alloys: electronic and magnetic propertiesCase Studies in Thermal Engineering20240 citations
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  5. Comprehensive first-principles investigation of electronic, optical, thermoelectric, and mechanical properties of Cs₂ZAuF₆ (Z = In, Tl) double perovskites for sustainable energy conversion

    Sarika Bajpai, Ali B.M. Ali, Preeti Kumari +6

    ArticleHeusler alloys: electronic and magnetic propertiesPolyhedron20250 citations
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  6. Tailoring the Optoelectronic and Thermoelectric Properties of Lead‐Free Double Perovskites K <sub>2</sub> NaBiZ <sub>6</sub> (Z = Br, I) for Renewable Energy Applications: A First‐Principles Density Functional Theory Investigation

    Aparna Dixit, Jisha Annie Abraham, Kaneez Fatima +6

    ArticlePerovskite Materials and ApplicationsEnergy Technology20250 citations
    ABI

  7. First-principles identification of PtTiGe and PtTiPb as high-efficiency thermoelectric half-Heuslers

    Mumtaz Manzoor, Ali B.M. Ali, Ramesh Sharma +5

    ArticleHeusler alloys: electronic and magnetic propertiesScientific Reports20260 citations
    ABI