Elementary energy bands in ab initio calculations of the YAlO3 and SbSI crystal band structure

Physical Review B - Condensed Matter and Materials Physics

Volumn 66, Issue 19, 2002, Pages 1952031-1952039

  Bercha, D M ^a   Rushchanskii, K Z ^b   Sznajder, M ^a,c   Matkovskii, A ^a   Potera, P ^a  

^a UNIVERSITY OF RZESZÓW   (Poland)

^b UZHGOROD NATIONAL UNIVERSITY   (Ukraine)

^c LVIV POLYTECHNIC NATIONAL UNIVERSITY   (Ukraine)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM OXIDE; ANTIMONY DERIVATIVE; IODIDE; METAL OXIDE; SULFIDE; YTTRIUM;

AB INITIO CALCULATION; ARTICLE; CRYSTAL STRUCTURE; ELECTRON; ENERGY; MATHEMATICAL ANALYSIS; STRUCTURE ANALYSIS; VIBRATION;

EID: 0037113710     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (50)

1. J. Zak, Phys. Rev. Lett. 45, 1025 (1980); 25, 1344 (1982).
2. J. Zak, Phys. Rev. Lett. 45, 1025 (1980); 25, 1344 (1982).
3. L. Michel and J. Zak, Phys. Rev. B 59, 5998 (1999).
4. L. Michel, in Symmetry and Structural Properties of Condensed Matter, in Proceeding of the 5th International School on the Symmetry and Structural Properties of Condensed Matter, edited by T. Lulek, B. Lulek, and A. Wal (World Scientific, Singapore, 1997), p. 478.
5. I. F. Elder and M. J. Payne, Opt. Commun. 148, 265 (1998); A. A. Kaminskii, Laser Crystals (Springer-Verlag, Berlin 1990), p. 456.
6. I. F. Elder and M. J. Payne, Opt. Commun. 148, 265 (1998); A. A. Kaminskii, Laser Crystals (Springer-Verlag, Berlin 1990), p. 456.
7. A. M. Grishin et al., Pis'ma Zh. Éksp. Teor. Fiz. 57, 498 (1993) [Pis'ma Zh. Eksp. Teor. Fiz. 57, 519 (1993)].
8. A. J. Wojtowicz, J. Glodo, A. Lempicki, and C. Brecher, J. Phys.: Condens. Matter 10, 8401 (1998).
9. M. Noginov et al., J. Opt. Soc. Am. B 15, 1463 (1998).
10. M. J. Weber, M. Bass, and K. Andriga, Appl. Phys. Lett. 15, 342 (1969).
11. K. W. Martin and L. G. Deshazer, Appl. Opt. 12, 941 (1973); V. N. Abramov and A. I. Kuznetsov, Fiz. Tverd. Tela (Leningrad) 20, 689 (1978) [Sov. Phys. JETP 20, 399 (1978)].
12. K. W. Martin and L. G. Deshazer, Appl. Opt. 12, 941 (1973); V. N. Abramov and A. I. Kuznetsov, Fiz. Tverd. Tela (Leningrad) 20, 689 (1978) [Sov. Phys. JETP 20, 399 (1978)].
13. T. Tomiki et al., J. Phys. Soc. Jpn. 60, 1799 (1991); 63, 1976 (1994).
14. T. Tomiki et al., J. Phys. Soc. Jpn. 60, 1799 (1991); 63, 1976 (1994).
15. T. Tomiki, F. Fukudome, and M. Kaminao, J. Lumin. 40/41, 379 (1988).
16. W. Y. Ching and Yong-Nian Xu, Phys. Rev. B 59, 12 815 (1999).
17. E. Doenges, Z. Anorg. Allg. Chem. 263, 112 (1950).
18. R. Arndt and A. Niggli, Naturwissenschaften 51, 158 (1964).
19. E. Fatuzzo et al., Phys. Rev. 127, 2036 (1962); R. Nitsche, H. Roetschi, and P. Wild, Appl. Phys. Lett. 4, 210 (1964).
20. E. Fatuzzo et al., Phys. Rev. 127, 2036 (1962); R. Nitsche, H. Roetschi, and P. Wild, Appl. Phys. Lett. 4, 210 (1964).
21. V. M. Fridkin, Ferroetectrics-Semiconductors (Nauka, Moscov, 1976), p. 408.
22. G. Harbeke, J. Phys. Chem. Solids 24, 957 (1963).
23. S. Geller and E. A. Wood, Acta Crystallogr. 9, 563 (1956); R. Diehl and G. Brant, Mater. Res. Bull. 10, 85 (1975).
24. S. Geller and E. A. Wood, Acta Crystallogr. 9, 563 (1956); R. Diehl and G. Brant, Mater. Res. Bull. 10, 85 (1975).
25. L. Vasylechko et al., J. Alloys Compd. 291, 57 (1999).
26. M. Yamaga, H. Takeuchi, T. J. Han, and B. Henderson, J. Phys.: Condens. Matter 5, 8097 (1993).
27. O. V. Kovalev, in Representations of the Crystallographic Space Groups. Irreducible Representations, Induced Representations and Corepresentations, edited by Harold T. Stokes and Dorian M. Hatch (Brigham Young University, Provo, 1993).
28. D. M. Bercha and O. B. Mitin, Fiz. Tekh. Polup. 21, 1508 (1987) [Fiz. Tekh. Poluprovodn. (S.-Peterburg) 21, 919 (1987)].
29. D. M. Bercha et al., Fiz. Tverd. Tela 39, 1219 (1997) [Fiz. Tverd. Tela (Leningrad) 39, 1081 (1997)].
30. D. M. Bercha, L. Yu. Kharkhalis, A. I. Bercha, and M. Sznajder, Phys. Status Solidi B 203, 427 (1997).
31. D. M. Bercha, O. B. Mitin, I. M. Rarenko, and B. N. Gritsyuk, Ukr. Fiz. Zh. (Russ. Ed.) 28, 1523 (1983).
32. N. Troullier and J. L. Martins, Phys. Rev. B 43, 1993 (1991).
33. J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981).
34. M. Ceperley and B. J. Alder, Phys. Rev. Lett. 45, 566 (1980).
35. M. Fuchs and M. Scheffler, Comput. Phys. Commun. 119, 67 (1998).
36. X. Gonze, R. Stumpf, and M. Scheffler, Phys. Rev. B 44, 8503 (1991).
37. M. Bockstedte, A. Kley, J. Neugebauer, and M. Scheffler, Comput. Phys. Commun. 107, 187 (1997).
38. The ABINIT code is a common project of the Universite Catholique de Louvain, Coming Incorporated, and other contributors (URL http://www.pcpm.ucl.ac.be/abinit).
39. D. J. Chadi and M. L. Cohen, Phys. Rev. B 8, 5757 (1973);
40. H. J. Monkhorst and J. D. Pack, ibid. 13, 5188 (1976).
41. M. S. Hybertsen and S. G. Louice, Phys. Rev. B 30, 5777 (1984).
42. K. Nakao and M. Balkanski, Phys. Rev. B 8, 5759 (1973); C. Y. Fong, Y. Petroff, S. Kohn, and Y. R. Shen, Solid State Commun. 14, 681 (1974).
43. K. Nakao and M. Balkanski, Phys. Rev. B 8, 5759 (1973); C. Y. Fong, Y. Petroff, S. Kohn, and Y. R. Shen, Solid State Commun. 14, 681 (1974).
44. J. F. Alward, C. Y. Fong, M. El-Batomouny, and F. Wollen, Solid State Commun. 25, 307 (1978).
45. D. M. Bercha, I. I. Nebola, and I. V. Bercha, Fiz. Tvedr. Tela 20, 1320 (1978) [Fiz. Tverd. Tela (Leningrad) 20, 759 (1978)].
46. International Tables for Crystallography, Space Groups Symmetry (Reidel, Dordrecht-Boston, 1983), Vol. A.
47. D. M. Bercha, M. Sznajder, and K. Z. Rushchanskii, in Proceedings of the 6th International School on Theoretical Physics, Symmetry and Structural Properties of Condensed Matter, Myczkowce, 2000, edited by T.Lulek, B. Lulek, and A. Wal (World Scientific, Singapore, 2001), p. 376.
48. I. Ya. Nikiforov and A. G. Khasabov, Fiz. Tverd. Tela (Leningrad) 13, 3589 (1970) [Fiz. Tverd. Tela (Leningrad) 13, 3030 (1972)].
49. I. J. Fritz, T. J. Isaacs, M. Gottlieb, and B. Morosin, Solid State Commun. 27, 535 (1978).
50. V. A. Stefanovich et al., Fiz. Tverd. Tela (Leningrad) 21, 843 (1979) [Fiz. Tverd. Tela (Leningrad) 21, 493 (1979)].