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

  1. BoltzTraP. A code for calculating band-structure dependent quantities

    Georg K. H. Madsen, David J. Singh

    MaqolaOchiq kirish200642 iqtibos
    ABI

  2. Wave-Number-Dependent Dielectric Function of Semiconductors

    David R. Penn

    Maqola196218 iqtibos
    ABI

  3. Structural, Electronic and Optical Properties of Titanium Based Fluoro-Perovskites MTiF<sub>3</sub> (M = Rb and Cs) via Density Functional Theory Computation

    Abdullah Abdullah, Umar Ayaz Khan, Sajid Khan +8

    MaqolaOchiq kirish202213 iqtibos
    ABI

  4. 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

  5. Cs<sub>2</sub>AgBiX<sub>6</sub> (X = Br, Cl): New Visible Light Absorbing, Lead-Free Halide Perovskite Semiconductors

    Eric T. McClure, Molly R. Ball, Wolfgang Windl +1

    Maqola20169 iqtibos
    ABI

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

    Maiza Zanib, Muhammad Waqas Iqbal, Mumtaz Manzoor +8

    Maqola20239 iqtibos
    ABI

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

    Abdullah Abdullah, Naimat Ullah Khan, Umar Ayaz Khan +8

    Maqola20238 iqtibos
    ABI

  8. Probing the physical properties of Sr3AsX3 (X = F and Br) perovskite compounds for prospective solar cell applications employing the DFT framework

    Ali Algahtani, Amina, Fida Rehman +8

    MaqolaPerovskite Materials and ApplicationsInorganic Chemistry Communications20247 iqtibos
    ABI

  9. Enhanced efficiency with CDCA co-adsorption for dye-sensitized solar cells based on metallosalophen complexes

    Jie Zhang, Aiguo Zhong, Guobo Huang +4

    Maqola20207 iqtibos
    ABI

  10. Potential lead-free small band gap halide double perovskites Cs2CuMCl6 (M = Sb, Bi) for green technology

    Muskan Nabi, Dinesh C. Gupta

    MaqolaOchiq kirish20216 iqtibos
    ABI

  11. Cs<sub>2</sub>NaGaBr<sub>6</sub>: a new lead-free and direct band gap halide double perovskite

    Y. Saeed, B. Amin, Haleema Khalil +5

    MaqolaOchiq kirish20206 iqtibos
    ABI

  12. Exploring the structural, opto-electronics and elastic properties of fluoro-perovskites KXF3 (X = Ir, Rh): A first-principles study

    Ali Algahtani, Naimat Ullah Khan, Abdullah Abdullah +8

    MaqolaHeusler alloys: electronic and magnetic propertiesInorganic Chemistry Communications20235 iqtibos
    ABI

  13. First principles insight on mechanical stability, optical and thermoelectric response of novel lead-free Rb2ScCuBr6 and Cs2ScCuBr6 double perovskites

    Ahmad Ayyaz, G. Murtaza, Ahmad Usman +3

    Maqola20234 iqtibos
    ABI

  14. <i>Ab initio</i> study of the bandgap engineering of Al1−xGaxN for optoelectronic applications

    B. Amin, Iftikhar Ahmad, Muhammad Maqbool +2

    MaqolaOchiq kirish20114 iqtibos
    ABI

  15. Unveiling the mechanical, structural, thermoelectric, and optoelectronic potential of K2NaGaBr6 and K2RbTlBr6 double perovskites for sustainable technologies

    Hudabia Murtaza, Quratul Ain, Junaid Munir +4

    Maqola20244 iqtibos
    ABI

  16. DFT analysis of elastic and optoelectronic properties of Cs2NaXCl6 (X=In, La, Sc, Y) double perovskite compounds

    Shakeel Shakeel, Peng Song, Syed Hatim Shah +5

    Maqola20244 iqtibos
    ABI

  17. The electronic, magnetic and optical properties of double perovskite A2FeReO6 (A = Sr, Ba) from first principles approach

    Dibya Prakash Rai, A. Shankar, Madhav Prasad Ghimire +2

    Maqola20154 iqtibos
    ABI

  18. Investigation of lead-free direct bandgap Ca<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si13.svg" display="inline" id="d1e887"><mml:msub><mml:mrow/><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:math>MAsO<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si14.svg" display="inline" id="d1e895"><mml:msub><mml:mrow/><mml:mrow><mml:mn>6</mml:mn></mml:mrow></mml:msub></mml:math> (M=Ga, In) double perovskites for optoelectronic and thermoelectric applications: A first principles study

    Abu Raihan, Mohammad Abdur Rashid, Mashnon Hasan Fahim +2

    Maqola20243 iqtibos
    ABI

  19. First-principles study of structural, mechanical, optical, and electronic properties of double perovskite RbBa2Ti3O10 material for photocatalytic applications

    Shoukat Hussain, Jalil Ur Rehman, Muhammad Bilal Tahir +1

    Maqola20243 iqtibos
    ABI

  20. A comprehensive theoretical analysis of the physical attributes of cesium-based Cs2LiTlCl6 double perovskites for eco-friendly technologies

    Hudabia Murtaza, Quratul Ain, Junaid Munir +4

    Maqola20243 iqtibos
    ABI

  21. Optoelectronic and thermoelectric transport phenomena in Sr2LaTaO6 and Sr2LuTaO6 double perovskites

    Mudassir Ishfaq, Muhammad Yaseen, Shazia Shukrullah +1

    Maqola20233 iqtibos
    ABI

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

    Amina, Muhammad Uzair, Amir Sohail Khan +10

    MaqolaOchiq kirishHeusler alloys: electronic and magnetic propertiesResults in Physics20242 iqtibos
    ABI

  23. A first-principle study of the electronic, mechanical and optical properties of inorganic perovskite Cs2SnI6 for intermediate-band solar cells

    Murugesan Rasukkannu, Dhayalan Velauthapillai, Ponniah Vajeeston

    Maqola20182 iqtibos
    ABI

  24. Electronic, phonon transport and thermoelectric properties of Cs2InAgCl6 from first-principles study

    Enamul Haque, Md.A. Hossain

    MaqolaOchiq kirish20192 iqtibos
    ABI

  25. Electronic, magnetic, optical and thermoelectric properties of Ca<sub>2</sub>Cr<sub>1−x</sub>Ni<sub>x</sub>OsO<sub>6</sub> double perovskites

    Shalika R. Bhandari, Dinesh Kumar Yadav, Bishnu Prasad Belbase +6

    MaqolaOchiq kirish20202 iqtibos
    ABI