Study of the hydrostatic pressure on orthorhombic IV-VI compounds including many-body effects

Computational Materials Science

Volumn 50, Issue 10, 2011, Pages 2872-2879

  Makinistian, L ^a,b   Albanesi, E A ^a,b  

^a Instituto de Desarrollo Tecnologico para la Industria Quimica   (Argentina)

^b UNIVERSIDAD NACIONAL DE ENTRE RÍOS   (Argentina)

Author keywords

Electron hole interaction; GW correction; Hydrostatic pressure; IV VI orthorhombic compounds; Optical properties

Indexed keywords

AB INITIO STUDY; ABSORPTION COEFFICIENTS; BAND GAPS; COMPARISON WITH EXPERIMENTS; DENSITIES OF STATE; DIELECTRIC FUNCTIONS; ELECTRON HOLE; ELECTRON-HOLE INTERACTIONS; EXPERIMENTAL DATA; GW CORRECTION; IMAGINARY PARTS; MANY-BODY EFFECT; ORTHORHOMBIC COMPOUNDS; PSEUDOPOTENTIAL APPROACH; QUASI PARTICLES; RESPONSE FUNCTIONS; SATISFACTORY DEGREE;

HYDRAULICS; HYDRODYNAMICS; HYDROSTATIC PRESSURE; OPTICAL PROPERTIES;

DENSITY FUNCTIONAL THEORY;

EID: 79959526649     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2011.05.002     Document Type: Article

References (76)

1. P. Dera Introduction to High-pressure Science, High-pressure Crystallography, from Fundamental Phenomena to Technological Applications 2009 Springer (Chapter 1)
2. A. Svane, N.E. Christensen, M. Cardona, A.N. Chantis, M. van Schilfgaarde, and T. Kotani Phys. Rev. B 81 2010 245120
3. P.F. McMillan High-pressure Synthesis of Materials, High-pressure Crystallography, from Fundamental Phenomena to Technological Applications 2009 Springer (Chapter 30)
4. G.R. Hearne Nanomaterials at High Pressure: Spectroscopy and Diffraction Techniques, High-pressure Crystallography, from Fundamental Phenomena to Technological Applications 2009 Springer (Chapter 41)
5. K.H.-L. Chau, R. Goehner, E. Drubetsky, H.M. Brady, W.H. Bayles Jr., and P.C. Pedersen Pressure and Sound Measurement, Measurements, Instrumentation & Sensors Handbook 1999 CRC Press (Chapter 26)
6. A.F. Goncharov, J.M. Zaug, J.C. Crowhurst, and E. Gregoryanz J. Appl. Phys. 97 2005 094917
7. Z. Shi, G. Xu, P.J. McCann, X.M. Fang, N. Dai, C.L. Felix, W.W. Bewley, I. Vurgaftman, and J. Meyer Appl. Phys. Lett. 6 25 2000
8. T. Schwarzl, M. Bberl, W. Heiss, G. Springholz, J. Fnrst, and H. Pascher Proc. GMe Forum 2003 103
9. M. Böberl, W. Heiss, T. Schwarzl, K. Wiesauer, and G. Springholz Appl. Phys. Lett. 82 23 2003
10. T. Schwarzl, W. Hei, G. Kocher-Oberlehner, and G. Springholz Semicond. Sci. Technol. 14 1999 L11
11. J. Shan, F.C.J.M. van Veggel, M. Raudsepp, A.G. Pattantyus-Abraham, J.F. Young, in: Proceedings of the 2006 NSTI Nanotechnology Conference and Tradeshow, vol. 3, 2006.
12. S.J. Wakeham, G.J. Hawkins, G.R. Henderson, N.A. Carthey, In: Proc. SPIE, Optics and Photonics Conference, Advances in Thin-Film Coatings for Optical Applications, vol. III, 2006, p. 62860C.
13. T.H. Patel, R. Vaidya, and S.G. Patel Bull. Mater. Sci. 26 6 2003 569
14. A. Agarwal, P.H. Trivedi, and D. Lakshmiranayana Cryst. Res. Technol. 40 8 2005 789
15. R.B. Shalvoy, G.B. Fisher, and P.J. Stiles Phys. Rev. B 15 1977 2021
16. P.C. Kemeny, J. Azoulay, M. Cardona, and L. Ley IL Nuovo Cimento 39 B 2 1977 709
17. Li-Ming Yu, A. Degiovanni, P.A. Thiry, J. Ghijsen, and R. Caudano Phys. Rev. B 47 1993 16222
18. R. Eymard, and A. Otto Phys. Rev. B 16 1977 1616
19. M. Taniguchi, R.L. Johnson, J. Ghijsen, and M. Cardona Phys. Rev. 42 6 1990 3634 and references therein
20. A. Tanuevski Semicond. Sci. Technol. 18 2003 501
21. A.W. Parke, and G.P. Srivastava Phys. Status Solidi B 101 1980 K31
22. F.M. Gashimzade, D.G. Guliev, D.A. Guseinova, and V.Y. Shteinshrayber J. Phys.: Condens. Matter 4 1992 1081
23. A.M. Elkorashy J. Phys. C 21 1988 2595 and references therein
24. J.D. Wiley, W.J. Buckel, and R.L. Schmidt Phys. Rev. B 13 1976 2489
25. H.R. Chandrasekhar, R.G. Humphreys, and M. Cardona Phys. Rev. B 16 1977 2981
26. T. Grandke, and L. Ley Phys. Rev. B 16 1977 832
27. H.C. Hsueh, M.C. Warren, H. Vass, G.J. Ackland, S.J. Clark, and J. Crain Phys. Rev. B 53 1996 14806
28. A. Onodera, I. Sakamoto, Y. Fujii, N. Môri, and S. Sugai Phys. Rev. B 56 13 1997 7935
29. L. Ehm, K. Knorr, P. Dera, A. Krimmel, P. Bouvier, and M. Mezouar J. Phys.: Condens. Matter 16 2004 3545
30. D. Pathinettam Padiyan, and A. Marikani Cryst. Res. Technol. 37 11 2002 1241
31. M. Durandurdu Phys. Rev. B 72 2005 144106
32. S. Alptekin, and M. Durandurdu Solid State Commun. 150 2010 870 874
33. L. Makinistian, and E.A. Albanesi Phys. Rev. B 74 2006 045206
34. L. Makinistian, and E.A. Albanesi J. Phys.: Condens. Matter 19 2007 186211
35. L. Makinistian, and E.A. Albanesi Phys. Status Solidi B 246 1 2009 183 191
36. R. Laskowski, N.E. Christensen, G. Santi, and C. Ambrosch-Draxl Phys. Rev. B 72 2005 035204
37. K. Hummer, C. Ambrosch-Draxl, G. Bussi, A. Ruini, M.J. Caldas, E. Molinari, R. Laskowski, and N.E. Christensen Phys. Status Solidi B 242 2005 1754
38. G. Onida, L. Reining, and A. Rubio Rev. Mod. Phys. 74 2002 601
39. S. Baroni, S. de Gironcoli, A.D. Corso, and P. Giannozzi Rev. Mod. Phys. 73 2001 515
40. L. Hedin, and S. Lundqvist Solid State Phys. 23 1970 1
41. L. Hedin Phys. Rev. 139 1965 A796
42. L. Hedin, S. Lundquist, in: H. Ehrenreich, F. Seitz, D. Turnbull (Eds.), Solid State Physics, vol. 23, Academic Press, New York, 1969, p. 1.
43. L. Thomas Proc. Camb. Philos. Soc. 23 1927 542
44. E. Fermi Z. Phys. 48 1928 73
45. P. Hohenberg, and W. Kohn Phys. Rev. 136 1964 864B
46. X. Gonze Comput. Mater. Sci. 25 2002 478 492
47. X. Gonze Z. Kristallogr. 220 2005 558
48. X. Gonze Comput. Mater. Sci. 180 2009 2582 2615
49. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
50. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 78 1997 1396
51. J.P. Perdew, S. Kurth, A. Zupan, and P. Blaha Phys. Rev. B 82 1999 2544
52. M. Fuchs, and M. Scheffler Comput. Phys. Commun. 119 1999 67 98
53. W. Kohn, and L. Sham Phys. Rev. 140 1965 1133
54. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
55. D.M. Teter, G.V. Gibbs, M.B. Boisen Jr., D.C. Allan, and M.P. Teter Phys. Rev. B 52 11 1995 8064
56. F.D. Murnaghan Proc. Natl. Acad. Sci. USA 30 1944 244
57. F. Birch J. Geophys. Res. 83 1978 1257
58. F. Birch Phys. Rev. 71 1947 809
59. E. Engel, and S. Vosko Phys. Rev. B 47 1993 13164
60. E. Engel, and S.H. Vosko Phys. Rev. B 50 1994 10498
61. S. Drablia, H. Meradji, S. Ghemid, S. Labidi, and B. Bouhafs Phys. Scr. 79 2009 045002
62. M. Dadsetani, and A. Pourghazi Optical Comm. 266 2006 562 564
63. N.E. Christensen, K. Hummer, and C. Ambrox-Draxl Phys. Rev. B 71 2005 081202-1
64. F. Ladstädter, U. Hohenester, P. Pusching, and C. Ambrosch-Draxl Phys. Rev. B 70 2004 235125-1
65. B. Arnaud, and M. Allouani Phys. Rev. B 63 2001 085208
66. B. Arnaud, and M. Alouani Phys. Rev. B 62 2000 4464
67. E.A. Albanesi, W.L. Lambrecht, and B. Segall J. Vac. Sci. Technol. B 12 1994 2470
68. R.D. Sole, and R. Girlanda Phys. Rev. B 48 1993 11789
69. S. Wey, and A. Zunger Phys. Rev. B 55 1977 13605
70. E.E. Salpeter, and H.A. Bethe Phys. Rev. B 84 1951 1232
71. R. Haydock Comput. Phys. Commun. 20 1980 11
72. G.V. Vajenine, X. Wang, I. Efthimiopoulos, S. Karmakar, K. Syassen, and M. Hanfland Phys. Rev. B 79 2009 224107
73. S. Radescu, A. Mujica, J. López-Solano, and R.J. Needs Phys. Rev. B 83 2011 094107
74. D. Vogel, P. Krnger, and J. Pollmann Phys. Rev. B 54 1996 5495
75. M. Parenteau, and C. Carlone Phys. Rev. B 41 1990 5227
76. G. Valiukonis, F.M. Gashimzade, D.A. Guseinova, G. Krivait, A.M. Kulibekov, G.S. Orudzhev, and A. Šileika Phys. Status Solidi B 117 1983 81