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Работы, на которые ссылается эта работа

Работ: 71

Работа: 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

  1. Generalized Gradient Approximation Made Simple

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    Статья1996Цитирований: 153
    ABI

  2. Special points for Brillouin-zone integrations

    Hendrik J. Monkhorst, J.D. Pack

    Статья1976Цитирований: 60
    ABI

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

    Georg K. H. Madsen, David J. Singh

    Статья2006Цитирований: 37
    ABI

  4. The Compressibility of Media under Extreme Pressures

    F. D. Murnaghan

    Статья1944Цитирований: 34
    ABI

  5. Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

    Fabien Tran, Peter Blaha

    Статья2009Цитирований: 33
    ABI

  6. Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells

    Akihiro Kojima, Kenjiro Teshima, Yasuo Shirai +1

    Статья2009Цитирований: 33
    ABI

  7. Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides

    R. D. Shannon

    Статья1976Цитирований: 30
    ABI

  8. The Elastic Behaviour of a Crystalline Aggregate

    R. Hill

    Статья1952Цитирований: 21
    ABI

  9. 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

    Статья2024Цитирований: 18
    ABI

  10. Linear optical properties of solids within the full-potential linearized augmented planewave method

    Claudia Draxl, Jorge O. Sofo

    Статья2006Цитирований: 16
    ABI

  11. 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

    Статья2024Цитирований: 15
    ABI

  12. 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

    Статья2024Цитирований: 12
    ABI

  13. Theoretical predictions of structure and related properties of intermetallics

    D. G. Pettifor

    Статья1992Цитирований: 10
    ABI

  14. 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

    Статья2017Цитирований: 7
    ABI

  15. 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

    Статья2023Цитирований: 7
    ABI

  16. 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

    Статья2020Цитирований: 6
    ABI

  17. Vibrational and transport phenomenon in Cs2CdZnCl6 double perovskite: A DFT study

    Nazia Erum, Ramesh Sharma, Hamid Ullah +3

    Статья2023Цитирований: 6
    ABI

  18. Explored the potential of Rb2SeX6 (X=Cl, Br) double perovskites for energy harvesting devices: A DFT study

    Mumtaz Manzoor, Aparna Dixit, Muhammad Waqas Iqbal +6

    Статья2024Цитирований: 6
    ABI

  19. A comprehensive DFT analysis of the physical, optoelectronic and thermoelectric attributes of Ba2lnNbO6 double perovskites for eco-friendly technologies

    Aparna Dixit, Jisha Annie Abraham, Mumtaz Manzoor +3

    Статья2024Цитирований: 6
    ABI

  20. Tailoring the physical, optoelectronic and transport properties of novel lead-free Sodium perovskites Na2TeX6 (X = Cl, Br, I) using DFT computation for photovoltaic and thermal devices

    Mumtaz Manzoor, Mukhtiar Hussain, Muhammad Aslam +4

    Статья2024Цитирований: 6
    ABI

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

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

    Статья2016Цитирований: 5
    ABI

  22. DFT insights on the opto-electronic and thermoelectric properties of double perovskites K2AgSbX6 (X = Cl, Br) via halides substitutions for solar cell applications

    Muhammad Waqas Iqbal, Mumtaz Manzoor, Soumaya Gouadria +6

    Статья2023Цитирований: 5
    ABI

  23. Novel high-entropy perovskite titanate: A potential thermal protective material with improved thermophysical properties

    Chang Gao, Jinpeng Zhu, Songbo Ye +3

    Статья2024Цитирований: 4
    ABI

  24. Probing direct bandgap of double perovskites Rb2LiTlX6 (X = Cl, Br) and optoelectronic characteristics for Solar cell applications: DFT calculations

    Mumtaz Manzoor, Muhammad Waqas Iqbal, Muhammad Imran +4

    Статья2022Цитирований: 4
    ABI

  25. Exploring the physical properties of novel double perovskites A2InAsO6 (A=Sr, Ba) for renewable energy applications: Ab-initio calculations

    Anjali Kumari, Jisha Annie Abraham, Mumtaz Manzoor +4

    Статья2024Цитирований: 4
    ABI