A first principles study of electronic and optical properties of the polar quaternary chalcogenides β-A2Hg3Ge2S8(A=K and Rb)

Materials Science in Semiconductor Processing

Volumn 34, Issue , 2015, Pages 250-259

  Azam, Sikander ^a   Khan, Saleem Ayaz ^a  

^a UNIVERSITY OF WEST BOHEMIA   (Czech Republic)

Author keywords

Electronic structure; FPLAPW; Optical properties; Semiconductor

Indexed keywords

BAND STRUCTURE; CALCULATIONS; CHARGE DENSITY; ELECTRONIC DENSITY OF STATES; ELECTRONIC STRUCTURE; ENERGY DISSIPATION; ENERGY GAP; GERMANIUM; INORGANIC COMPOUNDS; OPTOELECTRONIC DEVICES; REFRACTIVE INDEX; RUBIDIUM; SEMICONDUCTOR MATERIALS; STRUCTURAL PROPERTIES;

BAND STRUCTURE CALCULATION; DIELECTRIC FUNCTION SPECTRA; ELECTRONIC AND OPTICAL PROPERTIES; ELECTRONIC CHARGE DENSITY; FIRST-PRINCIPLES CALCULATION; FP-LAPW; FULL POTENTIAL LINEAR AUGMENTED PLANE WAVES; FUNDAMENTAL CHARACTERISTICS;

OPTICAL PROPERTIES;

EID: 84924050815     PISSN: 13698001     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.mssp.2015.02.042     Document Type: Article

References (20)

1. A.H. Reshak, and S. Azam Opt. Mater. 37 2014 97 103
2. F. Rotermund, V. Petrov, and F. Noack Opt. Commun. 185 2000 177 183
3. B.J. Zhao, S.F. Zhu, Y.D. Li, F.L. Yu, Q.F. Li, Z.H. Li, X.H. Zhu, S.Y. Shao, and J. Lin Opt. Eng. 38 1999 2129 2133
4. V.V. Apollonov, S.P. Lebedev, G.A. Komandin, Y.A. Shakir, V.V. Badikov, Y.M. Andreev, and A.I. Gribenyukov Laser Phys. 9 1999 1236 1239
5. K.L. Vodopyanov, J.P. Maffetone, I. Zwieback, and W. Ruderman Appl. Phys. Lett. 75 1999 1204 1206
6. V.A. Gorobets, V.O. Petukhov, S.Y. Tochitskii, and V.V. Churakov J. Opt. Technol. 66 1999 53 57
7. M.G. Kanatzidis, J.-H. Liao, G.A. Marking, Alkali metal quaternary chalcogenides and process for the preparation thereof. United States Patent 5,614,128.
8. M. G. Kanatzidis, J.-H. Liao, G.A. Marking, Alkali metal quaternary chalcogenides and process for the preparation thereof. United States Patent 5,618,471.
9. M.A. Pell, and J.A. Ibers Chem. Ber. 130 1997 1
10. S.A. Sunshine, D. Kangand, and J.A. Ibers J. Am. Chem. Soc. 109 1987 6202
11. M.G. Kanatzidis, and H.C. Sutrik Prog. Inorg. Chem. 43 1995 151
12. G.A. Making, J.A. Hanko, and M.G. Kanatzidis Chem. Mater. 10 1998 1191
13. J.-H. Liao, G.M. Marking, K.F. Hsu, Y. Matsushita, M.D. Ewbank, R. Borwick, P. Cunningham, M.J. Rosker, and M.G. Kanatzidis J. Am. Chem. Soc. 125 2003 9484 9493
14. P. Hohenberg, and W. Kohn Phys. Rev. 136 1964 864
15. W. Kohn, and L.J. Sham. Phys. Rev. 140 1965 A1133
16. P. Blaha, K. Schwarz, G.K.H. Madsen, D. Kvasnicka, and J Luitz WIEN2k, An Augmented Plane Wave Plus Local Orbitals Program for Calculating Crystal Properties 2001 Vienna University of Technology Vienna, Austria
17. H. Ud Din et al. J. Alloy. Compd. 615 2014 507 513
18. F. Tran, and P. Blaha Phys. Rev. Lett. 102 2009 226401
19. F.D. Murnaghan Proc. Natl. Acad. Sci. USA 30 1944 244
20. F. Wooten Optical Properties of Solids 1972 Academic Press New York