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Ish: Fluoride‐Based Halide Double Perovskites X <sub>2</sub> BiAuF <sub>6</sub> (X = K, Rb): A Computational Insight into their Structural Integrity, Optoelectronic Performance, and Thermoelectric Potential

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

    Georg K. H. Madsen, David J. Singh

    Maqola200637 iqtibos
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  2. Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

    Fabien Tran, Peter Blaha

    Maqola200933 iqtibos
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  3. Linear optical properties of solids within the full-potential linearized augmented planewave method

    Claudia Draxl, Jorge O. Sofo

    Maqola200616 iqtibos
    ABI

  4. Wave-Number-Dependent Dielectric Function of Semiconductors

    David R. Penn

    Maqola196215 iqtibos
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  5. A DFT exploration of the optoelectronic and thermoelectric features of a novel halide double perovskite A<sub>2</sub>YAuI<sub>6</sub> (A = Rb, Cs) for solar cell and renewable energy applications

    Abrar Nazir, Aparna Dixit, Ejaz Ahmad Khera +3

    Maqola202415 iqtibos
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  6. New tolerance factor to predict the stability of perovskite oxides and halides

    Christopher J. Bartel, Christopher Sutton, Bryan R. Goldsmith +4

    Maqola201914 iqtibos
    ABI

  7. On the stability of crystal lattices. I

    Max Born

    Maqola194011 iqtibos
    ABI

  8. 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

  9. Cs<sub>2</sub>InAgCl<sub>6</sub>: A New Lead-Free Halide Double Perovskite with Direct Band Gap

    George Volonakis, Amir A. Haghighirad, Rebecca L. Milot +7

    Maqola20177 iqtibos
    ABI

  10. On the application of the tolerance factor to inorganic and hybrid halide perovskites: a revised system

    Will Travis, Emily Glover, Hugo Bronstein +2

    Maqola20167 iqtibos
    ABI

  11. Investigation on the electronic structure, optical, elastic, mechanical, thermodynamic and thermoelectric properties of wide band gap semiconductor double perovskite Ba<sub>2</sub>InTaO<sub>6</sub>

    Sajad Ahmad Dar, Ramesh Sharma, Vipul Srivastava +1

    Maqola20197 iqtibos
    ABI

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

    Muskan Nabi, Dinesh C. Gupta

    Maqola20216 iqtibos
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  13. Figure of merit ZT of a thermoelectric device defined from materials properties

    G. Jeffrey Snyder, Alemayouh H. Snyder

    Maqola20176 iqtibos
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  14. Tuning of the electronic bandgap of lead-free double perovskites K2AgBiX6 (X = Cl, Br) for solar cells applications and their thermoelectric characteristics

    Muhammad Waqas Iqbal, Mumtaz Manzoor, N.A. Noor +6

    Maqola20225 iqtibos
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  15. A Bismuth-Halide Double Perovskite with Long Carrier Recombination Lifetime for Photovoltaic Applications

    Adam H. Slavney, Te Hu, Aaron M. Lindenberg +1

    Maqola20165 iqtibos
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  16. The Role of Goldschmidt’s Tolerance Factor in the Formation of A<sub>2</sub>BX<sub>6</sub> Double Halide Perovskites and its Optimal Range

    Alexander E. Fedorovskiy, Nikita Drigo, Mohammad Khaja Nazeeruddin

    Maqola20194 iqtibos
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  17. Exploring structural, thermodynamic, elastic, electro-optic, and thermoelectric characteristics of double perovskites Rb2XInBr6 (X = Na, K) for photovoltaic applications: A DFT approach

    Ahmad Ayyaz, G. Murtaza, Maleeha Shafiq +3

    Maqola20234 iqtibos
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  18. First-principles study on the electronic and optical properties of Bi<sub>2</sub>WO<sub>6</sub>

    Haseeb Ahmad, Ali Rauf, Afaq Ahmad +2

    Maqola20214 iqtibos
    ABI

  19. The study optical, thermoelectric, and thermodynamic properties of double perovskites K2CuBiX6 (X = Cl, Br, I) for energy harvesting

    Hind Albalawi, Syed Awais Rouf, Taharh Zelai +5

    Maqola20233 iqtibos
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  20. Theoretical investigation of X2NaIO6 (X= Pb,Sr) double perovskites for thermoelectric and optoelectronic applications

    Asima Aziz, Shatha A. Aldaghfag, Muhammad Zahid +4

    Maqola20223 iqtibos
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  21. Investigation of cubic K2NaXBr6(X=Sc, Y) double perovskites for optical and thermoelectric devices

    Sanobar Jamshaid, Nasarullah, Shatha A. Aldaghfag +5

    Maqola20233 iqtibos
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  22. DFT investigation of optoelectronic and thermoelectric features of Ba2Ce(Sn,Pt)O6 double perovskites

    Mudassir Ishfaq, Shatha A. Aldaghfag, Muhammad Zahid +2

    Maqola20243 iqtibos
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  23. Optoelectronic and thermoelectric transport phenomena in Sr2LaTaO6 and Sr2LuTaO6 double perovskites

    Mudassir Ishfaq, Muhammad Yaseen, Shazia Shukrullah +1

    Maqola20233 iqtibos
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  24. Thermoelectric materials: Energy conversion between heat and electricity

    Xiao Zhang, Li‐Dong Zhao

    Maqola20153 iqtibos
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  25. Theoretical investigations of structural, electronic, optical and thermoelectric properties of oxide halide perovskite ACoO3 (A=Nd, Pr or La)

    H. Absike, N. Baaalla, Loubaba Attou +3

    Maqola20222 iqtibos
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