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Ish: Impact of halogens modifications on physical characteristics of lead-free hybrid double perovskites compounds Cs2YCuX6 (X=Cl, Br, and I) for energy storage applications: First principles investigations

  1. Generalized Gradient Approximation Made Simple

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    Maqola1996153 iqtibos
    ABI

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

    Georg K. H. Madsen, David J. Singh

    Maqola200637 iqtibos
    ABI

  3. A Novel Aluminum–Graphite Dual‐Ion Battery

    Xiaolong Zhang, Yongbing Tang, Fan Zhang +1

    Maqola201629 iqtibos
    ABI

  4. Reversible calcium alloying enables a practical room-temperature rechargeable calcium-ion battery with a high discharge voltage

    Meng Wang, Chunlei Jiang, Songquan Zhang +3

    Maqola201829 iqtibos
    ABI

  5. A density functional theory study of the structural, mechanical, optoelectronics and thermoelectric properties of InGeX3 (X = F, Cl) perovskites

    Abrar Nazir, Ejaz Ahmad Khera, Mumtaz Manzoor +3

    Maqola202418 iqtibos
    ABI

  6. Wave-Number-Dependent Dielectric Function of Semiconductors

    David R. Penn

    Maqola196215 iqtibos
    ABI

  7. 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
    ABI

  8. Finite Elastic Strain of Cubic Crystals

    Francis Birch

    Maqola194713 iqtibos
    ABI

  9. Tunable opto-electronic and thermoelectric response of alkali based half-Heusler semiconductors AMgN (A = Rb, Cs) for sustainable energy: A computational approach

    Abrar Nazir, Ejaz Ahmad Khera, Mumtaz Manzoor +2

    Maqola202413 iqtibos
    ABI

  10. First principles exploration of structural stability, optoelectronic and thermoelectric properties of BaXO3 (X = Hf, Ti, V) for solar cell applications

    Ejaz Ahmad Khera, Abrar Nazir, Mumtaz Manzoor +4

    Maqola202412 iqtibos
    ABI

  11. Electrochemical Hydrogen Storage Materials: State-of-the-Art and Future Perspectives

    Xuelu Xu, Yue Dong, Qingwen Hu +2

    Maqola202412 iqtibos
    ABI

  12. Computational Prediction of Structural, Optoelectronic, Thermodynamic, and Thermoelectric Response of the Cubic Perovskite RbTmCl<sub>3</sub> via DFT‐mBJ + SOC Studies

    Ejaz Ahmad Khera, Abrar Nazir, Zubair Ahmed +5

    Maqola202410 iqtibos
    ABI

  13. 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

  14. Screening the structural, optoelectronic and thermoelectric features of novel inverse perovskites X3MgNa (X= Cl, Br and I): A theoretical investigation

    Abrar Nazir, Ejaz Ahmad Khera, Mumtaz Manzoor +4

    Maqola20249 iqtibos
    ABI

  15. Theoretical Engineering of Structural, Electronic, and Optical Characteristics of Double Perovskite Sr2XWO6 (X = Co, Zn) for Optical Devices

    Abrar Nazir, Ejaz Ahmad Khera, Zeeshan Anjum +3

    Maqola20249 iqtibos
    ABI

  16. Efficient planar heterojunction perovskite solar cells by vapour deposition

    Mingzhen Liu, Michael B. Johnston, Henry J. Snaith

    Maqola20137 iqtibos
    ABI

  17. 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

  18. Unique Properties of Halide Perovskites as Possible Origins of the Superior Solar Cell Performance

    Wan‐Jian Yin, Tingting Shi, Yanfa Yan

    Maqola20146 iqtibos
    ABI

  19. 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

    Maqola20206 iqtibos
    ABI

  20. Perovskite solar cells: an emerging photovoltaic technology

    Nam‐Gyu Park

    Maqola20145 iqtibos
    ABI

  21. 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
    ABI

  22. Recent progress in stabilizing hybrid perovskites for solar cell applications

    Jianqing Chen, Xin Cai, Donghui Yang +7

    Maqola20174 iqtibos
    ABI

  23. Efficient, stable and scalable perovskite solar cells using poly(3-hexylthiophene)

    Eui Hyuk Jung, Nam Joong Jeon, Eun Young Park +5

    Maqola20194 iqtibos
    ABI

  24. 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
    ABI

  25. First-principles prediction of the ground-state crystal structure of double-perovskite halides Cs2AgCrX6 (X = Cl, Br, and I)

    Muhammad Saeed, Izaz Ul Haq, Awais Siddique Saleemi +4

    Maqola20214 iqtibos
    ABI