A first-principles study of the stability, electronic structure, and optical properties of halide double perovskite Rb2Sn1−xTexI6 for solar cell applications

Author:

Faizan Muhammad1234ORCID,Xie Jiahao5678ORCID,Murtaza Ghulam911034,Echeverría-Arrondo Carlos11121314,Alshahrani Thamraa115161718,Bhamu Kailash Chandra19202122ORCID,Laref Amel2315242526,Mora-Seró Iván11121314ORCID,Haidar Khan Shah1234

Affiliation:

1. Department of Physics

2. University of Peshawar

3. Peshawar 25120

4. Pakistan

5. State Key Laboratory of Superhard Materials and School of Materials Science and Engineering

6. Jilin University

7. Changchun 130012

8. China

9. Materials Modeling Lab

10. Islamia College University

11. Institute of Advanced Materials (INAM)

12. Universitat Jaume I

13. Castelló 12006

14. Spain

15. College of Science

16. Princess Nourah Bint Abdulrahman University

17. Riyadh 11671

18. Saudi Arabia

19. School of Chemical Engineering

20. University of Ulsan

21. Ulsan 44610

22. South Korea

23. Department of Physics and Astronomy

24. King Saud University

25. Riyadh 11451

26. Kingdom of Saudi Arabia

Abstract

Substitutional alloying can enhance the stability and improve the optoelectronic properties of vacancy-ordered double perovskite A2BX6 for potential photovoltaic application.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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