High-pressure study of the structural and elastic properties of defect-chalcopyrite HgGa2Se4

Journal of Applied Physics

Volumn 113, Issue 7, 2013, Pages

  Gomis, O ^a   Vilaplana, R ^a   Manjon F J ^a   Santamaria Perez D ^b   Errandonea, D ^c   Perez Gonzalez E ^d   Lopez Solano J ^d   Rodriguez Hernandez P ^d   Munoz A ^d   Tiginyanu, I M ^e   Ursaki, V V ^e  

^a UNIVERSITAT POLITÈCNICA DE VALÈNCIA   (Spain)

^b UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

^c UNIVERSITY OF VALENCIA   (Spain)

^d UNIVERSIDAD DE LA LAGUNA   (Spain)

^e INSTITUTE OF APPLIED PHYSICS   (Moldova)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; DEFECT CHALCOPYRITE STRUCTURE; ELASTIC PROPERTIES; EQUATION OF STATE; HIGH-PRESSURE X-RAY DIFFRACTIONS; PRESSURE DEPENDENCE; SELENIDES;

COMPRESSIBILITY; COPPER COMPOUNDS; DEFECTS; ELASTICITY; X RAY DIFFRACTION;

MERCURY COMPOUNDS;

EID: 84874638867     PISSN: 00218979     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4792495     Document Type: Article

References (78)

1. A. MacKinnon, in Tables of Numerical Data and Functional Relationships in Science and Technology, edited by, O. Madelung, M. Schulz, and, H. Weiss, Landolt-Börnstein New Series, Group III, Vol. 17, pt. h (Springer-Verlag, Berlin, 1985), p. 124.
2. A. N. Georgobiani, S. I. Radautsan, and I. M. Tiginyanu, Sov. Phys. Semicond. 19, 121 (1985).
3. J. E. Bernard and A. Zunger, Phys. Rev. B 37, 6835 (1988). 10.1103/PhysRevB.37.6835
4. X. Jiang and W. R. L. Lambrecht, Phys. Rev. B 69, 035201 (2004). 10.1103/PhysRevB.69.035201
5. A. Zunger, S. Wagner, and P. M. Petroff, J. Electron. Mater. 22, 3 (1993). 10.1007/BF02665719
6. A. Millan and M. C. Moron, J. Appl. Phys. 89, 1687 (2001). 10.1063/1.1337601
7. S. I. Radautsan and I. M. Tiginyanu, Jpn. J. Appl. Phys. 32S3, 5 (1993). Available at: http://jjap.jsap.jp/link?JJAPS/32S3/5.
8. N. V. Joshi, J. Luengo, and F. Vera, Mater. Lett. 61, 1926 (2007). 10.1016/j.matlet.2006.07.177
9. I. I. Burlakov, Y. Raptis, V. V. Ursaki, E. Anastassakis, and I. M. Tiginyanu, Solid State Commun. 101, 377 (1997). 10.1016/S0038-1098(96)00602-3
10. J. González, R. Rico, E. Calderón, M. Quintero, and M. Morocoima, Phys. Status. Solidi.B 211, 45 (1999). 10.1002/(SICI)1521- 3951(199901)211:1<45::AID-PSSB45>3.0.CO;2-8
11. V. V. Ursaki, I. I. Burlakov, I. M. Tiginyanu, Y. S. Raptis, E. Anastassakis, and A. Anedda, Phys. Rev. B 59, 257 (1999). 10.1103/PhysRevB.59. 257
12. M. Fuentes-Cabrera and O. F. Sankey, J. Phys.: Condens. Matter 13, 1669 (2001). 10.1088/0953-8984/13/8/305
13. M. Fuentes-Cabrera, J. Phys.: Condens. Matter 13, 10117 (2001). 10.1088/0953-8984/13/45/301
14. A. Grzechnik, V. V. Ursaki, K. Syassen, I. Loa, I. M. Tiginyanu, and M. Handfland, J. Solid State Chem. 160, 205 (2001). 10.1006/jssc.2001.9224
15. T. Mitani, S. Onari, K. Allakhverdiev, F. Gashimzade, and T. Kerimova, Phys. Status Solidi B 223, 287 (2001). 10.1002/1521-3951(200101)223:1<287:: AID-PSSB287>3.0.CO;2-B
16. A. Tatsi, D. Lampakis, E. Liarokapis, S. A. López, L. Martínez, and W. Giriat, High Press. Res. 22, 89 (2002). 10.1080/08957950211338
17. I. M. Tiginyanu, V. V. Ursaki, F. J. Manjón, and V. E. Tezlevan, J. Phys. Chem. Solids 64, 1603 (2003). 10.1016/S0022-3697(03)00098-2
18. T. Mitani, T. Naitou, K. Matsuishi, S. Onari, K. Allakhverdiev, F. Gashimzade, and T. Kerimova, Phys. Status Solidi B 235, 321 (2003). 10.1002/pssb.200301579
19. K. Allakhverdiev, F. Gashimzade, T. Kerimova, T. Mitani, T. Naitou, K. Matsuishi, and S. Onari, J. Phys. Chem. Solids 64, 1597 (2003). 10.1016/S0022-3697(03)00077-5
20. J. Marquina, Ch. Power, P. Grima, M. Morocoima, M. Quintero, B. couzinet, J. C. Chervin, P. Munsch, and J. González, J. Appl. Phys. 100, 093513 (2006). 10.1063/1.2358826
21. S. Meenakshi, V. Vijyakumar, B. K. Godwal, A. Eifler, I. Orgzall, S. Tkachev, and H. D. Hochheimer, J. Phys. Chem. Solids 67, 1660 (2006). 10.1016/j.jpcs.2006.02.015
22. D. Errandonea, R. S. Kumar, F. J. Manjón, V. V. Ursaki, and I. M. Tiginyanu, J. Appl. Phys. 104, 063524 (2008). 10.1063/1.2981089
23. S. Meenakshi, V. Vijyakumar, A. Eifler, and H. D. Hochheimer, J. Phys. Chem. Solids 71, 832 (2010). 10.1016/j.jpcs.2010.02.007
24. P. Singh, M. Sharma, U. P. Verma, and P. Jensen, Z. Kristallogr. 225, 508 (2010). 10.1524/zkri.2010.1301
25. F. J. Manjón, O. Gomis, P. Rodríguez-Hernández, E. Pérez-González, A. Muñoz, D. Errandonea, J. Ruiz-Fuertes, A. Segura, M. Fuentes-Cabrera, I. Tiginyanu, and V. V. Ursaki, Phys. Rev. B 81, 195201 (2010). 10.1103/PhysRevB.81.195201
26. O. Gomis, R. Vilaplana, F. J. Manjón, E. Pérez- González, J. López-Solano, P. Rodríguez-Hernández, A. Muñoz, D. Errandonea, J. Ruiz-Fuertes, A. Segura, D. Santamaría-Pérez, I. M. Tiginyanu, and V. V. Ursaki, J. Appl. Phys. 111, 013518 (2012). 10.1063/1.3675162
27. I. M. Tiginyanu, N. A. Modovyan, and O. D. Stoika, Fiz. Tverd. Tela (Leningrad) 34, 967 (1992);
28. I. M. Tiginyanu, N. A. Modovyan, and O. D. Stoika, Sov. Phys. Solid State 43, 527 (1992).
29. D. Errandonea, R. Boehler, S. Japel, M. Mezouar, and L. R. Benedetti, Phys. Rev. B 73, 092106 (2006). 10.1103/PhysRevB.73.092106
30. D. Errandonea, D. Santamaria-Perez, T. Bondarenko, and O. Khyzhun, Mater. Res. Bull. 45, 1732 (2010). 10.1016/j.materresbull.2010.06.061
31. D. Santamaría-Pérez, M. Marqués, R. Chuliá-Jordán, J. M. Menéndez, O. Gomis, J. Ruiz-Fuertes, J. A. Sans, D. Errandonea, and J. M. Recio, Inorg. Chem. 51, 5289 (2012). 10.1021/ic300236p
32. S. Klotz, J. C. Chervin, P. Munsch, and G. Le Marchand, J. Phys. D: Appl. Phys. 42, 075413 (2009). 10.1088/0022-3727/42/7/075413
33. D. Errandonea, Y. Meng, M. Somayazulu, and D. Häusermann, Physica B 355, 116 (2005). 10.1016/j.physb.2004.10.030
34. H. K. Mao, J. Xu, and P. M. Bell, J. Geophys. Res. 91, 4673, doi: 10.1029/JB091iB05p04673 (1986).
35. W. Kraus and G. Nolze, J. Appl. Crystallogr. 29, 301 (1996). 10.1107/S0021889895014920
36. G. Kresse and J. Hafner, Phys. Rev. B 47, 558 (1993); 10.1103/PhysRevB.47.558
37. G. Kresse and J. Hafner, Phys. Rev. B 49, 14251 (1994); 10.1103/PhysRevB.49.14251
38. G. Kresse and J. Furthmüller, Comput. Mater. Sci. 6, 15 (1996); 10.1016/0927-0256(96)00008-0
39. G. Kresse and J. Furthmüller, Phys. Rev. B 54, 11169 (1996). 10.1103/PhysRevB.54.11169
40. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 78, 1396 (1997). 10.1103/PhysRevLett.78.1396
41. J. P. Perdew, A. Ruzsinszky, G. I. Csonka, O. A. Vydrov, G. E. Scuseria, L. A. Constantin, X. Zhou, and K. Burke, Phys. Rev. Lett. 100, 136406 (2008). 10.1103/PhysRevLett.100.136406
42. N. Chetty, A. Muñoz, and R. M. Martin, Phys. Rev. B 40, 11934 (1989). 10.1103/PhysRevB.40.11934
43. S. Baroni, S. de Gironcoli, A. Dal Corso, and P. Giannozzi, Rev. Mod. Phys. 73, 515 (2001). 10.1103/RevModPhys.73.515
44. Y. Le Page and P. Saxe, Phys. Rev. B 65, 104104 (2002). 10.1103/PhysRevB.65.104104
45. O. Beckstein, J. E. Klepeis, G. L. W. Hart, and O. Pankratov, Phys. Rev. B 63, 134112 (2001). 10.1103/PhysRevB.63.134112
46. J. F. Nye, Physical Properties of Crystals. Their Representation by Tensor and Matrices (Oxford University Press, 1957).
47. H. Hahn, G. Frank, W. Klingler, A. D. Stoerger, and G. Stoerger, Z. Anorg. Allg. Chem. 279, 241 (1955). 10.1002/zaac.19552790502
48. L. Gastaldi, M. G. Simeone, and S. Viticoli, Solid State Commun. 55, 605 (1985). 10.1016/0038-1098(85)90821-X
49. E. Bandiello, D. Errandonea, D. Martinez-Garcia, D. Santamaria-Perez, and F. J. Manjon, Phys. Rev. B 85, 024108, (2012). 10.1103/PhysRevB.85.024108
50. J. Ruiz-Fuertes, D. Errandonea, R. Lacomba-Perales, A. Segura, J. González, F. Rodríguez, F. J. Manjón, S. Ray, P. Rodríguez-Hernández, A. Muñoz, Zh. Zhu, and C. Y. Tu, Phys. Rev. B 81, 224115 (2010). 10.1103/PhysRevB.81.224115
51. D. Santamaría-Pérez, L. Gracia, G. Garbarino, A. Beltrán, R. Chulia-Jordan, O. Gomis, D. Errandonea, Ch. Ferrer-Roca, D. Martínez-García, and A. Segura, Phys. Rev. B 84, 054102 (2011). 10.1103/PhysRevB.84.054102
52. O. Gomis, J. A. Sans, R. Lacomba-Perales, D. Errandonea, Y. Meng, J. C. Chervin, and A. Polian, Phys. Rev. B 86, 054121 (2012). 10.1103/PhysRevB.86. 054121
53. M. D. Frogley, J. L. Sly, and D. J. Dunstan, Phys. Rev. B 58, 12579 (1998). 10.1103/PhysRevB.58.12579
54. L. Garbato, F. Ledda, and A. Rucci, Prog. Cryst. Growth Charact. 15, 1 (1987). 10.1016/0146-3535(87)90008-6
55. C. K. Lowe-Ma and T. A. Vanderah, Acta Cryst. C 47, 919 (1991). 10.1107/S0108270190011192
56. J. W. Earley, Am. Mineral. 35, 337 (1950).
57. A. Kuhn, A. Chevy, and R. Chevalier, Phys. Status Solidi A 31, 469 (1975) 10.1002/pssa.2210310216.
58. S. Radescu, A. Mujica, J. López-Solano, and R. J. Needs, Phys. Rev. B 83, 094107 (2011). 10.1103/PhysRevB.83.094107
59. U. Schwarz, D. Olguin, A. Cantarero, M. Hanfland, and K. Syassen, Phys. Status Solidi B 244, 244 (2007). 10.1002/pssb.200672551
60. D.-W. Zhang, F.-T. Jin, and J. -M Yuan, Chin. Phys. Lett. 23, 1876 (2006) 10.1088/0256-307X/23/7/061.
61. K. Kumazaki, Phys. Status Solidi A 29, K55 (1975). 10.1002/pssa. 2210290154
62. R. Hill, Proc. Phys. Soc. London, Sect. A 65, 349 (1952). 10.1088/0370-1298/65/5/307
63. T. C. Chiang, J. Dumas, and Y. R. Shen, Solid State Commun 28, 173 (1978). 10.1016/0038-1098(78)90049-2
64. M. Gatulle, M. Fischer, and A. Chevy, Phys. Status Solidi B 119, 327 (1983). 10.1002/pssb.2221190137
65. J. M. Farley, G. A. Saunders, and D. Y. Chung, J. Phys. C: Solid State Phys. 6, 2010 (1973). 10.1088/0022-3719/6/12/004
66. J. M. Farley and G. A. Saunders, J. Phys. C: Solid State Phys. 5, 3021 (1972). 10.1088/0022-3719/5/21/008
67. S.-H. Ma, Z.-Y. Jiao, and X.-Z. Zhang, J. Mater. Sci. 47, 3849 (2012). 10.1007/s10853-011-6240-y
68. A. Reuss, Z. Angew. Math. Mech. 9, 49 (1929) 10.1002/zamm.19290090104.
69. W. Voigt, Lehrbuch der Kristallphysik (Teubner, Leipzig, 1928).
70. R. Caracas and T. B. Ballaran, Phys. Earth Planetary Interiors 181, 21 (2010). 10.1016/j.pepi.2010.04.004
71. Q. J. Liu, Z. T. Liu, and L. P. Feng, Commun. Theor. Phys. 56, 779 (2011). 10.1088/0253-6102/56/4/31
72. S. F. Pugh, Philos. Mag. 45, 823 (1954) 10.1080/14786440808520496.
73. K. Lau and A. K. McCurdy, Phys. Rev. B 58, 8980 (1998). 10.1103/PhysRevB.58.8980
74. G. Grimvall, B. Magyari-Köpe, V. Ozolinš, and K. A. Persson, Rev. Mod. Phys. 84, 945 (2012). 10.1103/RevModPhys.84.945
75. M. Born, Proc. Cambridge Philos. Soc. 36, 160 (1940). 10.1017/S0305004100017138
76. J. Wang, S. Yip, S. R. Phillpot, and D. Wolf, Phys. Rev. Lett. 71, 4182 (1993). 10.1103/PhysRevLett.71.4182
77. J. Wang, J. Li, S. Yip, S. Phillpot, and D. Wolf, Phys. Rev. B 52, 12627 (1995). 10.1103/PhysRevB.52.12627
78. F. Cleri, J. Wang, and S. Yip, J. Appl. Phys. 77, 1449 (1995). 10.1063/1.359577