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Physical Review B - Condensed Matter and Materials Physics

Volumn 84, Issue 9, 2011, Pages

Computational study of the structural phases of ZnO

(2) Molepo, Mahlaga P a Joubert, Daniel P a

a UNIVERSITY OF THE WITWATERSRAND (South Africa)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 80053494854 PISSN: 10980121 EISSN: 1550235X Source Type: Journal
DOI: 10.1103/PhysRevB.84.094110 Document Type: Article

Times cited : (43)

References (32)

1
- 0000510720
- SCIEAS 0036-8075 10.1126/science.137.3534.993
- C. H. Bates, W. B. White, and R. Roy, Science SCIEAS 0036-8075 10.1126/science.137.3534.993 137, 993 (1962).
- (1962) Science , vol.137 , pp. 993
- Bates, C.H.¹ White, W.B.² Roy, R.³

2
- 0001587358
- PRBMDO 1098-0121 10.1103/PhysRevB.53.11425
- H. Karzel, W. Potzel, M. Köfferlein, W. Schiessl, M. Steiner, U. Hiller, G. M. Kalvius, D. W. Mitchell, T. P. Das, P. Blaha, K. Schwarz, and M. P. Pasternak, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.53.11425 53, 11425 (1996).
- (1996) Phys. Rev. B , vol.53 , pp. 11425
- Karzel, H.¹ Potzel, W.² Köfferlein, M.³ Schiessl, W.⁴ Steiner, M.⁵ Hiller, U.⁶ Kalvius, G.M.⁷ Mitchell, D.W.⁸ Das, T.P.⁹ Blaha, P.¹⁰ Schwarz, K.¹¹ Pasternak, M.P.¹²

3
- 0001433684
- PRBMDO 1098-0121 10.1103/PhysRevB.58.14102
- S. Desgreniers, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.58.14102 58, 14102 (1998).
- (1998) Phys. Rev. B , vol.58 , pp. 14102
- Desgreniers, S.¹

4
- 69949104457
- JALCEU 0925-8388 10.1016/j.jallcom.2009.04.116
- M. Kalay, H. H. Kart, S. Ozdemir Kart, and T. Cagin, J. Alloys Compd. JALCEU 0925-8388 10.1016/j.jallcom.2009.04.116 484, 431 (2009).
- (2009) J. Alloys Compd. , vol.484 , pp. 431
- Kalay, M.¹ Kart, H.H.² Ozdemir Kart, S.³ Cagin, T.⁴

5
- 0037438010
- PRBMDO 1098-0121 10.1103/PhysRevB.67.035403
- B. Meyer and D. Marx, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.67. 035403 67, 035403 (2003).
- (2003) Phys. Rev. B , vol.67 , pp. 035403
- Meyer, B.¹ Marx, D.²

6
- 4143121663
- PRBMDO 1098-0121 10.1103/PhysRevB.62.1660
- J. E. Jaffe, J. A. Snyder, Z. Lin, and A. C. Hess, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.62.1660 62, 1660 (2000).
- (2000) Phys. Rev. B , vol.62 , pp. 1660
- Jaffe, J.E.¹ Snyder, J.A.² Lin, Z.³ Hess, A.C.⁴

7
- 2342435803
- PRBMDO 1098-0121 10.1103/PhysRevB.69.094306
- J. Serrano, A. H. Romero, F. J. Manjon, R. Lauck, M. Cardona, and A. Rubio, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.69.094306 69, 094306 (2004).
- (2004) Phys. Rev. B , vol.69 , pp. 094306
- Serrano, J.¹ Romero, A.H.² Manjon, F.J.³ Lauck, R.⁴ Cardona, M.⁵ Rubio, A.⁶

8
- 33751090427
- Stability of rocksalt phase of zinc oxide under strong compression: Synchrotron x-ray diffraction experiments and first-principles calculation studies
- DOI 10.1063/1.2357644
- H. Liu, J. Tse, and H. Mao, J. Appl. Phys. JAPIAU 0021-8979 10.1063/1.2357644 100, 093509 (2006). (Pubitemid 44772560)
- (2006) Journal of Applied Physics , vol.100 , Issue.9 , pp. 093509
- Liu, H.¹ Tse, J.S.² Mao, H.-K.³

9
- 0042113153
- PHRVAO 0031-899X 10.1103/PhysRev.140.A1133
- W. Kohn and L. J. Sham, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.140. A1133 140, A1133 (1965).
- (1965) Phys. Rev. , vol.140 , pp. 1133
- Kohn, W.¹ Sham, L.J.²

10
- 2842565972
- PRBMDO 1098-0121 10.1103/PhysRevB.54.16533
- J. P. Perdew, K. Burke, and Y. Wang, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.54.16533 54, 16533 (1996).
- (1996) Phys. Rev. B , vol.54 , pp. 16533
- Perdew, J.P.¹ Burke, K.² Wang, Y.³

11
- 10644250257
- PHRVAO 0031-899X 10.1103/PhysRev.136.B864
- P. Hohenberg and W. Kohn, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.136.B864 136, B864 (1964).
- (1964) Phys. Rev. , vol.136 , pp. 864
- Hohenberg, P.¹ Kohn, W.²

12
- 33845796060
- Theoretical study of ZnO phases using a screened hybrid density functional
- DOI 10.1103/PhysRevB.74.245115
- J. Uddin and G. E. Scuseria, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.74.245115 74, 245115 (2006). (Pubitemid 44970418)
- (2006) Physical Review B - Condensed Matter and Materials Physics , vol.74 , Issue.24 , pp. 245115
- Uddin, J.¹ Scuseria, G.E.²

13
- 44549088023
- JPCSAW 0022-3697 10.1016/j.jpcs.2007.12.009
- Y. Saeed, A. Shaukat, N. Ikram, and M. Tanveer, J. Phys. Chem. Solids JPCSAW 0022-3697 10.1016/j.jpcs.2007.12.009 69, 1676 (2008).
- (2008) J. Phys. Chem. Solids , vol.69 , pp. 1676
- Saeed, Y.¹ Shaukat, A.² Ikram, N.³ Tanveer, M.⁴

14
- 31944440504
- Structural and electronic properties of ZnO under high pressures
- DOI 10.1016/j.ssc.2005.12.020, PII S0038109805010136
- B. Amrani, I. Chiboub, S. Hiadsi, T. Benmessabih, and N. Hamdadou, Solid State Commun. SSCOA4 0038-1098 10.1016/j.ssc.2005.12.020 137, 395 (2006). (Pubitemid 43190027)
- (2006) Solid State Communications , vol.137 , Issue.7 , pp. 395-399
- Amrani, B.¹ Chiboub, I.² Hiadsi, S.³ Benmessabih, T.⁴ Hamdadou, N.⁵

15
- 0036870911
- PRBMDO 1098-0121 10.1103/PhysRevB.66.174106
- A. Zaoui and W. Sekkal, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.66.174106 66, 174106 (2002).
- (2002) Phys. Rev. B , vol.66 , pp. 174106
- Zaoui, A.¹ Sekkal, W.²

16
- 49049090540
- PHYBE3 0921-4526 10.1016/j.physb.2008.03.026
- Y. Azzaz, S. Kacimi, A. Zaoui, and B. Bouhafs, Physica B PHYBE3 0921-4526 10.1016/j.physb.2008.03.026 403, 3154 (2008).
- (2008) Physica B , vol.403 , pp. 3154
- Azzaz, Y.¹ Kacimi, S.² Zaoui, A.³ Bouhafs, B.⁴

17
- 66749129182
- PRBMDO 1098-0121 10.1103/PhysRevB.79.193201
- Z. Li, Y. Xu, G. Gao, T. Cui, and Y. Ma, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.79.193201 79, 193201 (2009).
- (2009) Phys. Rev. B , vol.79 , pp. 193201
- Li, Z.¹ Xu, Y.² Gao, G.³ Cui, T.⁴ Ma, Y.⁵

18
- 12844286241
- PHYBE3 1098-0121 10.1103/PhysRevB.47.558
- G. Kresse and J. Hafner, J. Phys. Rev. PHYBE3 1098-0121 10.1103/PhysRevB.47.558 47, 558 (1993).
- (1993) J. Phys. Rev. , vol.47 , pp. 558
- Kresse, G.¹ Hafner, J.²

19
- 0028763270
- JCOMEL 0953-8984 10.1088/0953-8984/6/40/015
- G. Kresse and J. Hafner, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/6/40/015 6, 8245 (1994).
- (1994) J. Phys. Condens. Matter , vol.6 , pp. 8245
- Kresse, G.¹ Hafner, J.²

20
- 33744691386
- PRLTAO 0031-9007 10.1103/PhysRevLett.45.566
- D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.45.566 45, 566 (1980).
- (1980) Phys. Rev. Lett. , vol.45 , pp. 566
- Ceperley, D.M.¹ Alder, B.J.²

21
- 26144450583
- PRBMDO 1098-0121 10.1103/PhysRevB.23.5048
- J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.23.5048 23, 5048 (1981).
- (1981) Phys. Rev. B , vol.23 , pp. 5048
- Perdew, J.P.¹ Zunger, A.²

22
- 25744460922
- PRBMDO 1098-0121 10.1103/PhysRevB.50.17953
- P. E. Blöchl, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.50. 17953 50, 17953 (1994).
- (1994) Phys. Rev. B , vol.50 , pp. 17953
- Blöchl, P.E.¹

23
- 0011236321
- PRBMDO 1098-0121 10.1103/PhysRevB.59.1758
- G. Kresse and D. Joubert, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.59.1758 59, 1758 (1999).
- (1999) Phys. Rev. B , vol.59 , pp. 1758
- Kresse, G.¹ Joubert, D.²

24
- 1842816907
- PRBMDO 1098-0121 10.1103/PhysRevB.13.5188
- H. J. Monkhorst and J. D. Pack, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.13.5188 13, 5188 (1976).
- (1976) Phys. Rev. B , vol.13 , pp. 5188
- Monkhorst, H.J.¹ Pack, J.D.²

25
- 0004092136
- Universität Wien, Wien, Australia
- G. Kresse and J. Furthmüller, VASP the GUIDE (Universität Wien, Wien, Australia, 2005).
- (2005) VASP the GUIDE
- Kresse, G.¹ Furthmüller, J.²

26
- 36149027186
- PHRVAO 0031-899X 10.1103/PhysRev.71.809
- F. Birch, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.71.809 71, 809 (1947).
- (1947) Phys. Rev. , vol.71 , pp. 809
- Birch, F.¹

27
- 33645224313
- PRBMDO 1098-0121 10.1103/PhysRevB.70.054104
- S. Limpijumnong and S. Jungthawan, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.70.054104 70, 054104 (2004).
- (2004) Phys. Rev. B , vol.70 , pp. 054104
- Limpijumnong, S.¹ Jungthawan, S.²

28
- 0037113417
- PRBMDO 1098-0121 10.1103/PhysRevB.66.205205
- Roberto J. Guerrero-Moreno and Noboru Takeuchi, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.66.205205 66, 205205 (2002).
- (2002) Phys. Rev. B , vol.66 , pp. 205205
- Guerrero-Moreno, R.J.¹ Takeuchi, N.²

29
- 33745318866
- First-principles study of ground- And excited-state properties of MgO, ZnO, and CdO polymorphs
- DOI 10.1103/PhysRevB.73.245212
- A. Schleife, F. Fuchs, J. Furthmuller, and F. Bechstedt, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.73.245212 73, 245212 (2006). (Pubitemid 43938703)
- (2006) Physical Review B - Condensed Matter and Materials Physics , vol.73 , Issue.24 , pp. 245212
- Schleife, A.¹ Fuchs, F.² Furthmuller, J.³ Bechstedt, F.⁴

30
- 0000189414
- PRBMDO 1098-0121 10.1103/PhysRevB.48.7903
- J. E. Jaffe and A. C. Hess, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.48.7903 48, 7903 (1993).
- (1993) Phys. Rev. B , vol.48 , pp. 7903
- Jaffe, J.E.¹ Hess, A.C.²

31
- 34249067330
- PSSBBD 0370-1972 10.1002/pssb.200675132
- J. Wróbel and J. Piechota, Phys. Status Solidi B PSSBBD 0370-1972 10.1002/pssb.200675132 244, 1538 (2007).
- (2007) Phys. Status Solidi B , vol.244 , pp. 1538
- Wróbel, J.¹ Piechota, J.²

32
- 2142645129
- PRBMDO 1098-0121 10.1103/PhysRevB.70.094114
- H. Liu, H. K. Mao, M. Somayazulu, Y. Ding, Y. Meng, and D. Hausermann, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.70.094114 70, 094114 (2004).
- (2004) Phys. Rev. B , vol.70 , pp. 094114
- Liu, H.¹ Mao, H.K.² Somayazulu, M.³ Ding, Y.⁴ Meng, Y.⁵ Hausermann, D.⁶

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