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67 ta ish

Ish: First principles insight into Cs<sub>2</sub>YZnX<sub>6</sub> (X = Br, I) double perovskite materials for optoelectronic and thermoelectric device applications

  1. BoltzTraP2, a program for interpolating band structures and calculating semi-classical transport coefficients

    Georg K. H. Madsen, Jesús Carrete, Matthieu J. Verstraete

    Maqola201814 iqtibos
    ABI

  2. Structural, electronic, magnetic and elastic properties of xenon-based fluoroperovskites XeMF<sub>3</sub> (M = Ti, V, Zr, Nb) <i>via</i> DFT studies

    Abdullah Abdullah, Muhammad Sajjad, Umar Ayaz Khan +6

    Maqola202213 iqtibos
    ABI

  3. How To Correctly Determine the Band Gap Energy of Modified Semiconductor Photocatalysts Based on UV–Vis Spectra

    Patrycja Makuła, Michał Pacia, Wojciech Macyk

    Maqola201811 iqtibos
    ABI

  4. 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

  5. First-principle insight into the structural, electronic, elastic and optical properties of Cs-based double perovskites Cs<sub>2</sub>XCrCl<sub>6</sub> (X = K, Na)

    Jehan Y. Al‐Humaidi, Abd Ullah, Naimat Ullah Khan +7

    Maqola20239 iqtibos
    ABI

  6. Optoelectronic and thermoelectric properties of new lead-free K2NaSbZ6 (Z = Br, I) halide double-perovskites for clean energy applications: a DFT study

    Abderrazak Boutramine, Samah Al‐Qaisi, Saidi Samah +6

    Maqola20247 iqtibos
    ABI

  7. 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

  8. Oxide perovskites, double perovskites and derivatives for electrocatalysis, photocatalysis, and photovoltaics

    Wan‐Jian Yin, Baicheng Weng, Jie Ge +3

    Maqola20187 iqtibos
    ABI

  9. A Simple Derivation of the Birch–Murnaghan Equations of State (EOSs) and Comparison with EOSs Derived from Other Definitions of Finite Strain

    Tomoo Katsura, Yoshinori Tange

    Maqola20197 iqtibos
    ABI

  10. Detail computational study about the structural, electronic, optical, and mechanical properties of RbVX<sub>3</sub> (Cl, Br, I) halide perovskite materials

    Naimat Ullah Khan, Javed Iqbal, Abdullah Abdullah +8

    Maqola20237 iqtibos
    ABI

  11. 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

    Maqola20237 iqtibos
    ABI

  12. First-Principles Insights into Structural, Optoelectronic, and Elastic Properties of Fluoro-Perovskites KXF<sub>3</sub> (X = Ru, Os)

    Jehan Y. Al‐Humaidi, Javed Iqbal, Abdullah Abdullah +9

    MaqolaPerovskite Materials and ApplicationsACS Omega20235 iqtibos
    ABI

  13. A Bismuth-Halide Double Perovskite with Long Carrier Recombination Lifetime for Photovoltaic Applications

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

    Maqola20165 iqtibos
    ABI

  14. DFT Analysis of Ba2NbRhO6: A Promising Double Perovskite for Sustainable Energy Applications

    Soufyane Belhachi, Samah Al‐Qaisi, Saidi Samah +7

    Maqola20245 iqtibos
    ABI

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

    Jianqing Chen, Xin Cai, Donghui Yang +7

    Maqola20174 iqtibos
    ABI

  16. Electronic Structural, Optical and Elastic Properties of K-Based Lead-Free Perovskites KXF3 (X = Nb, Ti, Zr) via DFT Computational Approach

    Jehan Y. Al‐Humaidi, Abdullah Abdullah, Amina +7

    MaqolaPerovskite Materials and ApplicationsJournal of Inorganic and Organometallic Polymers and Materials20234 iqtibos
    ABI

  17. Air-Stable Molecular Semiconducting Iodosalts for Solar Cell Applications: Cs<sub>2</sub>SnI<sub>6</sub> as a Hole Conductor

    Byunghong Lee, Constantinos C. Stoumpos, Nan Zhou +6

    Maqola20144 iqtibos
    ABI

  18. Performance of the Vienna ab initio simulation package (VASP) in chemical applications

    Guangyu Sun, J. Kürti, Péter Rajczy +3

    Maqola20034 iqtibos
    ABI

  19. Lead-Free Halide Double Perovskite Materials: A New Superstar Toward Green and Stable Optoelectronic Applications

    Liang Chu, Waqar Ahmad, Wei Liu +5

    Sharh maqola20193 iqtibos
    ABI

  20. Semiconductor nanoheterostructures for photoconversion applications

    Mei-Jing Fang, Chun‐Wen Tsao, Yung‐Jung Hsu

    Maqola20193 iqtibos
    ABI

  21. Lead‐Free Double Perovskites for Perovskite Solar Cells

    Po-Kai Kung, Ming-Hsien Li, Pei-Ying Lin +5

    Maqola20193 iqtibos
    ABI

  22. First-principles calculations to investigate structural, electronic, optical, and magnetic properties of a scintillating double perovskite halide (Cs2LiCeCl6)

    Sadia Khawar, Momina Afzal, Mudasser Husain +8

    Maqola20223 iqtibos
    ABI

  23. Investigation of structural, magneto-electronic, elastic, mechanical and thermoelectric properties of novel lead-free halide double perovskite Cs2AgFeCl6: First-principles calcuations

    Khatir Radja, Blaha Lamia Farah, Ibrahim Ameri +6

    Maqola20223 iqtibos
    ABI

  24. Optical-Vibrational Properties of the Cs<sub>2</sub>SnX<sub>6</sub>(X = Cl, Br, I) Defect Perovskites and Hole-Transport Efficiency in Dye-Sensitized Solar Cells

    Andreas Kaltzoglou, Μαρία Αντωνιάδου, Athanassios G. Kontos +8

    Maqola20163 iqtibos
    ABI

  25. Rational Design of Halide Double Perovskites for Optoelectronic Applications

    Xingang Zhao, Dongwen Yang, Ji‐Chang Ren +3

    Maqola20183 iqtibos
    ABI