The influence of replacing Se by Te on electronic structure and optical properties of Tl4PbX3(X = Se or Te): experimental and theoretical investigations

Author:

Reshak A. H.12345,Alahmed Z. A.6789,Barchij I. E.10111213,Sabov M. Yu.10111213,Plucinski K. J.14151617,Kityk I. V.18192017,Fedorchuk A. O.212213

Affiliation:

1. New Technologies - Research Centre

2. University of West Bohemia

3. 306 14 Pilsen

4. Czech Republic

5. Center of Excellence Geopolymer and Green Technology

6. Department of Physics and Astronomy

7. King Saud University

8. Riyadh 11451

9. Saudi Arabia

10. Department of Chemistry

11. Uzhgorod National University

12. Uzhgorod

13. Ukraine

14. Electronics Department

15. Military University Technology

16. Warsaw 00-908

17. Poland

18. Faculty of Electrical Engineering

19. Czestochowa University Technology

20. Czestochowa

21. Lviv National University of Veterinary Medicine and Biotechnologies

22. 79010 Lviv

Abstract

The energy band structure, electronic charge density and optical features of Tl4PbSe3and Tl4PbTe3single crystals were studied within a framework of the recently modified Becke–Johnson potential (mBJ).

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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