SCOPUS 정보 검색 플랫폼

Physical Review B - Condensed Matter and Materials Physics

Volumn 89, Issue 7, 2014, Pages

Prediction of structure candidates for zinc oxide as a function of pressure and investigation of their electronic properties

(4) Zagorac, D a Schon J C a Zagorac, J a Jansen, M a

a MAX PLANCK INSTITUT FÜR FESTKÖRPERFORSCHUNG (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84894811052 PISSN: 10980121 EISSN: 1550235X Source Type: Journal
DOI: 10.1103/PhysRevB.89.075201 Document Type: Article

Times cited : (74)

References (109)

1
- 25144462707
- A comprehensive review of ZnO materials and devices
- DOI 10.1063/1.1992666, 041301
- Ü. Özgür, Ya. I. Alivov, C. Liu, A. Teke, M. A. Reshchikov, S. Doǧan, V. Avrutin, S.-J. Cho, and H. Morkoç, J. Appl. Phys. 98, 041301 (2005). JAPIAU 0021-8979 10.1063/1.1992666 (Pubitemid 41348664)
- (2005) Journal of Applied Physics , vol.98 , Issue.4 , pp. 1-103
- Ozgur, U.¹ Alivov, Ya.I.² Liu, C.³ Teke, A.⁴ Reshchikov, M.A.⁵ Dogan, S.⁶ Avrutin, V.⁷ Cho, S.-J.⁸ Morko, H.⁹

2
- 43049091242
- WEARCJ 0043-1648 10.1016/j.wear.2007.11.013
- A. Hernandez-Battez, R. González, J. L. Viesca, J. E. Fernández, J. M. Díaz Fernández, A. Machado, R. Chou, and J. Riba, Wear 265, 422 (2008). WEARCJ 0043-1648 10.1016/j.wear.2007.11.013
- (2008) Wear , vol.265 , pp. 422
- Hernandez-Battez, A.¹ González, R.² Viesca, J.L.³ Fernández, J.E.⁴ Díaz Fernández, J.M.⁵ MacHado, A.⁶ Chou, R.⁷ Riba, J.⁸

3
- 0040523455
- An electron density residual study of zinc oxide
- DOI 10.1006/jssc.1996.0095
- H. Sawada, R. Wang, and A. W. Sleight, J. Sol. Stat. Chem. 122, 148 (1996). 10.1006/jssc.1996.0095 (Pubitemid 126315790)
- (1996) Journal of Solid State Chemistry , vol.122 , Issue.1 , pp. 148-150
- Sawada, H.¹ Wang, R.² Sleight, A.W.³

4
- 0242664727
- JAPIAU 0021-8979 10.1063/1.1617357
- T.-B. Hur, G. S. Jeen, Y.-H. Hwang, and H.-K. Kim, J. Appl. Phys. 94, 5787 (2003). JAPIAU 0021-8979 10.1063/1.1617357
- (2003) J. Appl. Phys. , vol.94 , pp. 5787
- Hur, T.-B.¹ Jeen, G.S.² Hwang, Y.-H.³ Kim, H.-K.⁴

5
- 0141596093
- Effects of dopants and hydrogen on the electrical conductivity of ZnO
- DOI 10.1016/S0955-2219(03)00336-4
- Z. Zhou, K. Kato, T. Komaki, M. Yoshino, H. Yukawa, M. Morinaga, and K. Morita, J. Eur. Ceram. Soc. 24, 139 (2004). JECSER 0955-2219 10.1016/S0955-2219(03)00336-4 (Pubitemid 37160088)
- (2004) Journal of the European Ceramic Society , vol.24 , Issue.1 , pp. 139-146
- Zhou, Z.¹ Kato, K.² Komaki, T.³ Yoshino, M.⁴ Yukawa, H.⁵ Morinaga, M.⁶ Morita, K.⁷

6
- 0141463546
- (Academic Press, San Diego)
- T. Suski and W. Paul, High Pressure in Semiconductor Physics I, Semiconductors and Semimetals, Vol. 54, (Academic Press, San Diego, 1998).
- (1998) High Pressure in Semiconductor Physics I, Semiconductors and Semimetals , vol.54
- Suski, T.¹ Paul, W.²

7
- 34248212800
- CPCHFT 1439-4235 10.1002/cphc.200700002
- C. Klingshirn, Chem. Phys. Chem. 8, 782 (2007). CPCHFT 1439-4235 10.1002/cphc.200700002
- (2007) Chem. Phys. Chem. , vol.8 , pp. 782
- Klingshirn, C.¹

8
- 80052538080
- NNOTER 0957-4484 10.1088/0957-4484/22/39/395603
- D. Lukovic Golic, G. Brankovic, M. Pocuca Nesic, K. Vojisavljevic, A. Recnik, N. Daneu, S. Bernik, M. Scepanovic, D. Poleti, and Z. Brankovic, Nanotechnology 22, 395603 (2011). NNOTER 0957-4484 10.1088/0957-4484/22/39/ 395603
- (2011) Nanotechnology , vol.22 , pp. 395603
- Lukovic Golic, D.¹ Brankovic, G.² Pocuca Nesic, M.³ Vojisavljevic, K.⁴ Recnik, A.⁵ Daneu, N.⁶ Bernik, S.⁷ Scepanovic, M.⁸ Poleti, D.⁹ Brankovic, Z.¹⁰

9
- 11044236143
- ZnO nanowire growth and devices
- DOI 10.1016/j.mser.2004.09.001, PII S0927796X04001135
- Y. W. Heo, D. P. Norton, L. C. Tien, Y. Kwon, B. S. Kang, F. Ren, S. J. Pearton, and J. R. LaRoche, Mater. Sci. Eng. R 47, 1 (2004). 10.1016/j.mser.2004.09.001 (Pubitemid 40043232)
- (2004) Materials Science and Engineering R: Reports , vol.47 , Issue.1-2 , pp. 1-47
- Heo, Y.W.¹ Norton, D.P.² Tien, L.C.³ Kwon, Y.⁴ Kang, B.S.⁵ Ren, F.⁶ Pearton, S.J.⁷ Laroche, J.R.⁸

10
- 34547780710
- Laminates of zinc oxide and poly(amino acid) layers with enhanced mechanical performance
- DOI 10.1088/0957-4484/18/34/345707, PII S0957448407486093
- P. Lipowsky, Z. Burghard, L. P. H. Jeurgens, J. Bill, and F. Aldinger, Nanotechnology 18, 345707 (2007). NNOTER 0957-4484 10.1088/0957-4484/18/34/ 345707 (Pubitemid 47228461)
- (2007) Nanotechnology , vol.18 , Issue.34 , pp. 345707
- Lipowsky, P.¹ Burghard, Z.² Jeurgens, L.P.H.³ Bill, J.⁴ Aldinger, F.⁵

11
- 84874584692
- 10.1016/j.jallcom.2013.01.178
- I. Kuryliszyn-Kudelska, B. Hadzic, D. Sibera, M. Romcevic, N. Romcevic, U. Narkiewicz, W. Lojkowski, M. Arciszewska, and W. Dobrowolski, J. Alloy. Compd. 561, 247 (2013). 10.1016/j.jallcom.2013.01.178
- (2013) J. Alloy. Compd. , vol.561 , pp. 247
- Kuryliszyn-Kudelska, I.¹ Hadzic, B.² Sibera, D.³ Romcevic, M.⁴ Romcevic, N.⁵ Narkiewicz, U.⁶ Lojkowski, W.⁷ Arciszewska, M.⁸ Dobrowolski, W.⁹

12
- 84872071982
- PPCPFQ 1463-9076 10.1039/c2cp41680h
- M. Behrens, G. Lolli, N. Muratova, I. Kasatkin, M. Havecker, R. Naumann d'Alnoncourt, O. Storcheva, K. Kohler, M. Muhlerd, and R. Schlogla, Phys. Chem. Chem. Phys. 15, 1374 (2013). PPCPFQ 1463-9076 10.1039/c2cp41680h
- (2013) Phys. Chem. Chem. Phys. , vol.15 , pp. 1374
- Behrens, M.¹ Lolli, G.² Muratova, N.³ Kasatkin, I.⁴ Havecker, M.⁵ Naumann D'Alnoncourt, R.⁶ Storcheva, O.⁷ Kohler, K.⁸ Muhlerd, M.⁹ Schlogla, R.¹⁰

13
- 84874550555
- PRBMDO 0163-1829 10.1103/PhysRevB.87.085306
- M. Liu, G.-B. Ma, X. Xiong, Z.-W. Wang, R.-W. Peng, J.-G. Zheng, D.-J. Shu, Z. Zhang, and M. Wang, Phys. Rev. B 87, 085306 (2013). PRBMDO 0163-1829 10.1103/PhysRevB.87.085306
- (2013) Phys. Rev. B , vol.87 , pp. 085306
- Liu, M.¹ Ma, G.-B.² Xiong, X.³ Wang, Z.-W.⁴ Peng, R.-W.⁵ Zheng, J.-G.⁶ Shu, D.-J.⁷ Zhang, Z.⁸ Wang, M.⁹

14
- 79951815073
- JAPIAU 0021-8979 10.1063/1.3525987
- M. Šćepanović, M. Grujić-Brojčin, K. Vojisavljević, and T. Srećković, J. Appl. Phys. 109, 034313 (2011). JAPIAU 0021-8979 10.1063/1.3525987
- (2011) J. Appl. Phys. , vol.109 , pp. 034313
- Šćepanović, M.¹ Grujić-Brojčin, M.² Vojisavljević, K.³ Srećković, T.⁴

15
- 0001192839
- Hierarchical ZnO nanostructures
- DOI 10.1021/nl025753t
- J. Y. Lao, J. G. Wen, and Z. F. Ren, Nano Lett. 2, 1287 (2002). NALEFD 1530-6992 10.1021/nl025753t (Pubitemid 135706513)
- (2002) Nano Letters , vol.2 , Issue.11 , pp. 1287-1291
- Lao, J.Y.¹ Wen, J.G.² Ren, Z.F.³

16
- 50149111093
- JCCHDD 0192-8651 10.1002/jcc.21051
- C. R. A. Catlow, S. A. French, A. A. Sokol, A. A. Al- Sunaidi, and S. M. Woodley, J. Comput. Chem. 29, 2234 (2008). JCCHDD 0192-8651 10.1002/jcc.21051
- (2008) J. Comput. Chem. , vol.29 , pp. 2234
- Catlow, C.R.A.¹ French, S.A.² Sokol, A.A.³ Al- Sunaidi, A.A.⁴ Woodley, S.M.⁵

17
- 33745891514
- Analytic bond-order potential for atomistic simulations of zinc oxide
- DOI 10.1088/0953-8984/18/29/003, PII S0953898406252123, 003
- P. Erhart, N. Juslin, O. Goy, K. Nordlund, R. Muller, and K. Albe, J. Phys.: Condens. Matter 18, 6585 (2006). 10.1088/0953-8984/18/29/003 (Pubitemid 44042978)
- (2006) Journal of Physics Condensed Matter , vol.18 , Issue.29 , pp. 6585-6605
- Erhart, P.¹ Juslin, N.² Goy, O.³ Nordlund, K.⁴ Muller, R.⁵ Albe, K.⁶

18
- 33748496260
- Novel phase transformation in ZnO nanowires under tensile loading
- DOI 10.1103/PhysRevLett.97.105502
- A. J. Kulkarni, M. Zhou, K. Sarasamak, and S. Limpijumnong, Phys. Rev. Lett. 97, 105502 (2006). PRLTAO 0031-9007 10.1103/PhysRevLett.97.105502 (Pubitemid 44359819)
- (2006) Physical Review Letters , vol.97 , Issue.10 , pp. 105502
- Kulkarni, A.J.¹ Zhou, M.² Sarasamak, K.³ Limpijumnong, S.⁴

19
- 4143121663
- PRBMDO 0163-1829 10.1103/PhysRevB.62.1660
- J. E. Jaffe, J. A. Snyder, Z. Lin, and A. C. Hess, Phys. Rev. B 62, 1660 (2000). PRBMDO 0163-1829 10.1103/PhysRevB.62.1660
- (2000) Phys. Rev. B , vol.62 , pp. 1660
- Jaffe, J.E.¹ Snyder, J.A.² Lin, Z.³ Hess, A.C.⁴

20
- 84874886728
- PRBMDO 0163-1829 10.1103/PhysRevB.87.125302
- Z. Zeng, C. S. Garoufalis, S. Baskoutas, and G. Bester, Phys. Rev. B 87, 125302 (2013). PRBMDO 0163-1829 10.1103/PhysRevB.87.125302
- (2013) Phys. Rev. B , vol.87 , pp. 125302
- Zeng, Z.¹ Garoufalis, C.S.² Baskoutas, S.³ Bester, G.⁴

21
- 61449199700
- NALEFD 1530-6992 10.1021/nl801169x
- A. Kawska, P. Duchstein, O. Hochrein, and D. Zahn, Nano Lett. 8, 2336 (2008). NALEFD 1530-6992 10.1021/nl801169x
- (2008) Nano Lett. , vol.8 , pp. 2336
- Kawska, A.¹ Duchstein, P.² Hochrein, O.³ Zahn, D.⁴

22
- 80053330222
- JMACEP 0959-9428 10.1039/c1jm12383a
- M. A. Zwijnenburg and S. T. Bromley, J. Mater. Chem. 21, 15255 (2011). JMACEP 0959-9428 10.1039/c1jm12383a
- (2011) J. Mater. Chem. , vol.21 , pp. 15255
- Zwijnenburg, M.A.¹ Bromley, S.T.²

23
- 84875770071
- JCPSA6 0021-9606 10.1063/1.4796602
- W. Hu, Z. Li, and J. Yang, J. Chem. Phys. 138, 124706 (2013). JCPSA6 0021-9606 10.1063/1.4796602
- (2013) J. Chem. Phys. , vol.138 , pp. 124706
- Hu, W.¹ Li, Z.² Yang, J.³

24
- 84866976172
- PRBMDO 0163-1829 10.1103/PhysRevB.86.115334
- A. Kronenberger, A. Polity, D. M. Hofmann, B. K. Meyer, A. Schleife, and F. Bechstedt, Phys. Rev. B 86, 115334 (2012). PRBMDO 0163-1829 10.1103/PhysRevB.86.115334
- (2012) Phys. Rev. B , vol.86 , pp. 115334
- Kronenberger, A.¹ Polity, A.² Hofmann, D.M.³ Meyer, B.K.⁴ Schleife, A.⁵ Bechstedt, F.⁶

25
- 52949118521
- 10.1103/PhysRevB.78.125204
- S. E. Boulfelfel and S. Leoni, Phys Rev. B 78, 125204 (2008). 10.1103/PhysRevB.78.125204
- (2008) Phys Rev. B , vol.78 , pp. 125204
- Boulfelfel, S.E.¹ Leoni, S.²

26
- 84862530794
- PRLTAO 0031-9007 10.1103/PhysRevLett.108.259601
- B. G. Kim, Phys. Rev. Lett. 108, 259601 (2012). PRLTAO 0031-9007 10.1103/PhysRevLett.108.259601
- (2012) Phys. Rev. Lett. , vol.108 , pp. 259601
- Kim, B.G.¹

27
- 0003582429
- (Oxford University Press, New York)
- W. D. Nesse, Introduction to Mineralogy (Oxford University Press, New York, 2000).
- (2000) Introduction to Mineralogy
- Nesse, W.D.¹

28
- 0013649206
- (Oxford University Press, New York)
- M. Allaby, Dictionary of Earth Sciences (Oxford University Press, New York, 2008).
- (2008) Dictionary of Earth Sciences
- Allaby, M.¹

29
- 0004291816
- (Mineralogical Society of America, Chantilly, Virginia, USA)
- J. W. Anthony, R. A. Bideaux, K. W. Bladh, and M. C. Nichols, Handbook of Mineralogy (Mineralogical Society of America, Chantilly, Virginia, USA, 2013).
- (2013) Handbook of Mineralogy
- Anthony, J.W.¹ Bideaux, R.A.² Bladh, K.W.³ Nichols, M.C.⁴

30
- 84894760150
- (Springer Materials - The Landolt-Bornstein Database, Berlin, Heidelberg, Germany)
- B. Predel and O. Madelung, O-Zn (Oxygen-Zinc) (Springer Materials-The Landolt-Bornstein Database, Berlin, Heidelberg, Germany, 2013).
- (2013) O-Zn (Oxygen-Zinc)
- Predel, B.¹ Madelung, O.²

31
- 33645234693
- 10.1107/S0021889805042457
- H. Sowa and H. Ahsbahs, J. Appl. Cryst. 39, 169 (2006). 10.1107/S0021889805042457
- (2006) J. Appl. Cryst. , vol.39 , pp. 169
- Sowa, H.¹ Ahsbahs, H.²

32
- 0000510720
- 10.1126/science.137.3534.993
- C. H. Bates, W. B. White, and R. Roy, Science 137, 993 (1962). 10.1126/science.137.3534.993
- (1962) Science , vol.137 , pp. 993
- Bates, C.H.¹ White, W.B.² Roy, R.³

33
- 28244448467
- Rietveld refinement study of the pressure dependence of the internal structural parameter u in the wurtzite phase of ZnO
- DOI 10.1103/PhysRevB.71.212103, 212103
- H. Liu, Y. Ding, M. Somayazulu, J. Qian, J. Shu, D. Häusermann, and H.-K. Mao, Phys. Rev. B 71, 212103 (2005). 10.1103/PhysRevB.71.212103 (Pubitemid 41703030)
- (2005) Physical Review B - Condensed Matter and Materials Physics , vol.71 , Issue.21 , pp. 1-4
- Liu, H.¹ Ding, Y.² Somayazulu, M.³ Qian, J.⁴ Shu, J.⁵ Hausermann, D.⁶ Mao, H.-K.⁷

34
- 25344433507
- 10.4028/www.scientific.net/MSF.79-82.419
- H. Karzel, U. Potzel, W. Potzel, J. Moser, C. Schaefer, M. Steiner, M. Peter, A. Kratzer, and G. M. Kalvius, Mater. Sci. Forum 79, 419 (1991). 10.4028/www.scientific.net/MSF.79-82.419
- (1991) Mater. Sci. Forum , vol.79 , pp. 419
- Karzel, H.¹ Potzel, U.² Potzel, W.³ Moser, J.⁴ Schaefer, C.⁵ Steiner, M.⁶ Peter, M.⁷ Kratzer, A.⁸ Kalvius, G.M.⁹

35
- 0142244707
- PRBMDO 0163-1829 10.1103/PhysRevB.68.104101
- F. Decremps, F. Datchi, A. M. Saitta, A. Polian, S. Pascarelli, A. Di Cicco, J. P. Itie, and F. Baudelet, Phys. Rev. B 68, 104101 (2003). PRBMDO 0163-1829 10.1103/PhysRevB.68.104101
- (2003) Phys. Rev. B , vol.68 , pp. 104101
- Decremps, F.¹ Datchi, F.² Saitta, A.M.³ Polian, A.⁴ Pascarelli, S.⁵ Di Cicco, A.⁶ Itie, J.P.⁷ Baudelet, F.⁸

36
- 0001811176
- 10.1039/tf9322800522
- W. Bragg and J. A. Darbyshire, Trans. Farad. Soc. 28, 522 (1932). 10.1039/tf9322800522
- (1932) Trans. Farad. Soc. , vol.28 , pp. 522
- Bragg, W.¹ Darbyshire, J.A.²

37
- 0031828281
- 10.1093/oxfordjournals.jmicro.a023570
- T. Kogure and Y. Bando, J. Elec. Microscopy 47, 135 (1998). 10.1093/oxfordjournals.jmicro.a023570
- (1998) J. Elec. Microscopy , vol.47 , pp. 135
- Kogure, T.¹ Bando, Y.²

38
- 0037468011
- APPLAB 0003-6951 10.1063/1.1536253
- S.-K. Kim, S.-Y. Jeong, and C. R. Cho, Appl. Phys. Lett. 82, 562 (2003). APPLAB 0003-6951 10.1063/1.1536253
- (2003) Appl. Phys. Lett. , vol.82 , pp. 562
- Kim, S.-K.¹ Jeong, S.-Y.² Cho, C.R.³

39
- 0000601652
- APPLAB 0003-6951 10.1063/1.125851
- A. B. M. A. Ashrafi, A. Ueta, A. Avramescu, H. Kumano, I. Suemune, Y. Ok, and T. Seong, Appl. Phys. Lett. 76, 550 (2000). APPLAB 0003-6951 10.1063/1.125851
- (2000) Appl. Phys. Lett. , vol.76 , pp. 550
- Ashrafi, A.B.M.A.¹ Ueta, A.² Avramescu, A.³ Kumano, H.⁴ Suemune, I.⁵ Ok, Y.⁶ Seong, T.⁷

40
- 0002624487
- 10.1016/0927-0256(95)00016-J
- J. C. Schön and M. Jansen, Comp. Mater. Sci. 4, 43 (1995). 10.1016/0927-0256(95)00016-J
- (1995) Comp. Mater. Sci. , vol.4 , pp. 43
- Schön, J.C.¹ Jansen, M.²

41
- 84907777260
- 10.2298/PAC1301037Z
- D. Zagorac, J. C. Schön, and M. Jansen, Process. Appl. Ceram. 7, 37 (2013). 10.2298/PAC1301037Z
- (2013) Process. Appl. Ceram. , vol.7 , pp. 37
- Zagorac, D.¹ Schön, J.C.² Jansen, M.³

42
- 77954849503
- CMATEX 0897-4756 10.1021/cm101240n
- C. L. Pueyo, S. Siroky, S. Landsmann, M. W. E. van den Berg, M. R. Wagner, J. S. Reparaz, A. Hoffmann, and S. Polarz, Chem. Mater. 22, 4263 (2010). CMATEX 0897-4756 10.1021/cm101240n
- (2010) Chem. Mater. , vol.22 , pp. 4263
- Pueyo, C.L.¹ Siroky, S.² Landsmann, S.³ Berg Den Van, E.M.W.⁴ Wagner, M.R.⁵ Reparaz, J.S.⁶ Hoffmann, A.⁷ Polarz, S.⁸

43
- 34547193740
- Observation of depolarized ZnO(0001) monolayers: Formation of unreconstructed planar sheets
- DOI 10.1103/PhysRevLett.99.026102
- C. Tusche, H. L. Meyerheim, and J. Kirschner, Phys. Rev. Lett. 99, 026102 (2007). PRLTAO 0031-9007 10.1103/PhysRevLett.99.026102 (Pubitemid 47117043)
- (2007) Physical Review Letters , vol.99 , Issue.2 , pp. 026102
- Tusche, C.¹ Meyerheim, H.L.² Kirschner, J.³

44
- 12444262340
- Growth of ZnO thin films - Experiment and theory
- DOI 10.1039/b414111c
- F. Claeyssens, C. L. Freeman, N. L. Allan, Y. Sun, M. N. R. Ashfold, and J. H. J. Harding, Mater. Chem. 15, 139 (2005). MACHDW 0390-6035 10.1039/b414111c (Pubitemid 40143752)
- (2005) Journal of Materials Chemistry , vol.15 , Issue.1 , pp. 139-148
- Claeyssens, F.¹ Freeman, C.L.² Allan, N.L.³ Sun, Y.⁴ Ashfold, M.N.R.⁵ Harding, J.H.⁶

45
- 20044383271
- Ab initio investigations of optical properties of the high-pressure phases of ZnO
- DOI 10.1103/PhysRevB.71.125132, 125132
- J. Sun, H.-T. Wang, J. He, and Y. Tian, Phys. Rev. B 71, 125132 (2005). PRBMDO 0163-1829 10.1103/PhysRevB.71.125132 (Pubitemid 40771095)
- (2005) Physical Review B - Condensed Matter and Materials Physics , vol.71 , Issue.12 , pp. 1-5
- Sun, J.¹ Wang, H.-T.² He, J.³ Tian, Y.⁴

46
- 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. 137, 395 (2006). SSCOA4 0038-1098 10.1016/j.ssc.2005.12.020 (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

47
- 41949093536
- SSCOA4 0038-1098 10.1016/j.ssc.2008.03.001
- J. Wrobel and J. Piechota, Solid State Commun. 146, 324 (2008). SSCOA4 0038-1098 10.1016/j.ssc.2008.03.001
- (2008) Solid State Commun. , vol.146 , pp. 324
- Wrobel, J.¹ Piechota, J.²

48
- 66749129182
- PRBMDO 0163-1829 10.1103/PhysRevB.79.193201
- Z. Li, Y. Xu, G. Gao, T. Cui, and Y. Ma, Phys. Rev. B 79, 193201 (2009). PRBMDO 0163-1829 10.1103/PhysRevB.79.193201
- (2009) Phys. Rev. B , vol.79 , pp. 193201
- Li, Z.¹ Xu, Y.² Gao, G.³ Cui, T.⁴ Ma, Y.⁵

49
- 64549091515
- 10.1016/j.jallcom.2008.08.052
- S. Cui, W. Feng, H. Hu, Z. Feng, and Y. Wang, J. Alloy. Compd. 476, 306 (2009). 10.1016/j.jallcom.2008.08.052
- (2009) J. Alloy. Compd. , vol.476 , pp. 306
- Cui, S.¹ Feng, W.² Hu, H.³ Feng, Z.⁴ Wang, Y.⁵

50
- 69949104457
- 10.1016/j.jallcom.2009.04.116
- M. Kalay, H. H. Kart, S. Ö. Kart, and T. CagIn, J. Alloy. Compd. 484, 431 (2009). 10.1016/j.jallcom.2009.04.116
- (2009) J. Alloy. Compd. , vol.484 , pp. 431
- Kalay, M.¹ Kart, H.H.² Kart, S.O.³ Cagin, T.⁴

51
- 84872966931
- CHPLBC 0009-2614 10.1016/j.cplett.2012.11.096
- S. Zhang, Y. Zhang, S. Huang, P. Wang, and H. Tian, Chem. Phys. Lett. 557, 102 (2013). CHPLBC 0009-2614 10.1016/j.cplett.2012.11.096
- (2013) Chem. Phys. Lett. , vol.557 , pp. 102
- Zhang, S.¹ Zhang, Y.² Huang, S.³ Wang, P.⁴ Tian, H.⁵

52
- 10844272478
- High-pressure X-ray structural study of BeO and ZnO to 200 GPa
- DOI 10.1002/pssb.200405247
- Y. Mori, N. Niiya, K. Ukegawa, T. Mizuno, K. Takarabe, and A. L. Ruoff, Phys. Status Solidi B 241, 3198 (2004). PSSBBD 0370-1972 10.1002/pssb.200405247 (Pubitemid 40004354)
- (2004) Physica Status Solidi (B) Basic Research , vol.241 , Issue.14 , pp. 3198-3202
- Mori, Y.¹ Niiya, N.² Ukegawa, K.³ Mizuno, T.⁴ Takarabe, K.⁵ Ruoff, A.L.⁶

53
- 84865027235
- 10.2298/PAC1102073Z
- D. Zagorac, J. C. Schön, I. Pentin, and M. Jansen, Process. Appl. Ceram. 5, 73 (2011). 10.2298/PAC1102073Z
- (2011) Process. Appl. Ceram. , vol.5 , pp. 73
- Zagorac, D.¹ Schön, J.C.² Pentin, I.³ Jansen, M.⁴

54
- 79960123160
- D. Zagorac, J. C. Schön, and M. Jansen, Acta Phys. Pol. A 120, 215 (2011).
- (2011) Acta Phys. Pol. A , vol.120 , pp. 215
- Zagorac, D.¹ Schön, J.C.² Jansen, M.³

55
- 84894775924
- J. C. Schön and M. Jansen, Angew. Chem., Int. Ed Eng. 35, 1268 (1996).
- (1996) Angew. Chem., Int. Ed Eng. , vol.35 , pp. 1268
- Schön, J.C.¹ Jansen, M.²

56
- 77951986464
- PSSBBD 0370-1972 10.1002/pssb.200945246
- J. C. Schön, K. Doll, and M. Jansen, Phys. Status Solidi (b) 247, 23 (2010). PSSBBD 0370-1972 10.1002/pssb.200945246
- (2010) Phys. Status Solidi (B) , vol.247 , pp. 23
- Schön, J.C.¹ Doll, K.² Jansen, M.³

57
- 26444479778
- SCIEAS 0036-8075 10.1126/science.220.4598.671
- S. Kirkpatrick, C. D. Gelatt, and M. P. Vecchi, Science 220, 671 (1983). SCIEAS 0036-8075 10.1126/science.220.4598.671
- (1983) Science , vol.220 , pp. 671
- Kirkpatrick, S.¹ Gelatt, C.D.² Vecchi, M.P.³

58
- 77955887619
- 10.1107/S0108767310026371
- M. Jansen, K. Doll, and J. C. Schön, Acta Crystallogr. A 66, 518 (2010). 10.1107/S0108767310026371
- (2010) Acta Crystallogr. A , vol.66 , pp. 518
- Jansen, M.¹ Doll, K.² Schön, J.C.³

59
- 0001786236
- 10.1098/rspa.1980.0135
- S. W. de Leeuw, J. W. Perram, and E. R. Smith, Proc. Roy. Soc. London A 373, 27 (1980). 10.1098/rspa.1980.0135
- (1980) Proc. Roy. Soc. London A , vol.373 , pp. 27
- De Leeuw, S.W.¹ Perram, J.W.² Smith, E.R.³

60
- 84255197303
- PPCPFQ 1463-9076 10.1039/c1cp22446h
- S. Neelamraju, J. C. Schön, K. Doll, and M. Jansen, Phys. Chem. Chem. Phys. 14, 1223 (2012). PPCPFQ 1463-9076 10.1039/c1cp22446h
- (2012) Phys. Chem. Chem. Phys. , vol.14 , pp. 1223
- Neelamraju, S.¹ Schön, J.C.² Doll, K.³ Jansen, M.⁴

61
- 20144378220
- CRYSTAL: A computational tool for the ab initio study of the electronic properties of crystals
- DOI 10.1524/zkri.220.5.571.65065
- R. Dovesi, R. Orlando, B. Civalleri, C. Roetti, V. R. Saunders, and C. M. Zicovich-Wilson, Z. Kristallogr. 220, 571 (2005). 10.1524/zkri.220.5.571.65065 (Pubitemid 40778243)
- (2005) Zeitschrift fur Kristallographie , vol.220 , Issue.5-6 , pp. 571-573
- Dovesi, R.¹ Orlando, R.² Civalleri, B.³ Roetti, C.⁴ Saunders, V.R.⁵ Zicovich-Wilson, C.M.⁶

62
- 78650830129
- (University of Torino, Torino, Italy)
- R. Dovesi, V. R. Saunders, C. Roetti, R. Orlando, C. M. Zicovich-Wilson, F. Pascale, B. Civalleri, K. Doll, N. M. Harrison, I. J. Bush, P. D'Arco, and M. Llunell, CRYSTAL09 User's Manual (University of Torino, Torino, Italy, 2009).
- (2009) CRYSTAL09 User's Manual
- Dovesi, R.¹ Saunders, V.R.² Roetti, C.³ Orlando, R.⁴ Zicovich-Wilson, C.M.⁵ Pascale, F.⁶ Civalleri, B.⁷ Doll, K.⁸ Harrison, N.M.⁹ Bush, I.J.¹⁰ D'Arco, P.¹¹ Llunell, M.¹²

63
- 0001027957
- Hartree-Fock geometry optimisation of periodic systems with the CRYSTAL code
- DOI 10.1016/S0009-2614(01)01081-8, PII S0009261401010818
- B. Civalleri, P. D'Arco, R. Orlando, V. R. Saunders, and R. Dovesi, Chem. Phys. Lett. 348, 131 (2001). CHPLBC 0009-2614 10.1016/S0009-2614(01)01081-8 (Pubitemid 33628573)
- (2001) Chemical Physics Letters , vol.348 , Issue.1-2 , pp. 131-138
- Civalleri, B.¹ D'Arco, P.² Orlando, R.³ Saunders, V.R.⁴ Dovesi, R.⁵

64
- 0035281512
- Analytical Hartree-Fock gradients for periodic systems
- DOI 10.1002/1097-461X(2001)82:1<1::AID-QUA1017>3.0.CO;2-W
- K. Doll, V. R. Saunders, and N. M. Harrison, Int. J. Quantum Chem. 82, 1 (2001). IJQCB2 0020-7608 10.1002/1097-461X(2001)82:1<1::AID-QUA1017>3.0. CO;2-W (Pubitemid 32228105)
- (2001) International Journal of Quantum Chemistry , vol.82 , Issue.1 , pp. 1-13
- Doll, K.¹ Saunders, V.R.² Harrison, N.M.³

65
- 0035370697
- Implementation of analytical Hartree-Fock gradients for periodic systems
- DOI 10.1016/S0010-4655(01)00172-2, PII S0010465501001722
- K. Doll, Comput. Phys. Commun. 137, 74 (2001). CPHCBZ 0010-4655 10.1016/S0010-4655(01)00172-2 (Pubitemid 32491716)
- (2001) Computer Physics Communications , vol.137 , Issue.1 , pp. 74-88
- Doll, K.¹

66
- 11944252045
- Analytical Hartree-Fock gradients with respect to the cell parameter for systems periodic in three dimensions
- DOI 10.1007/s00214-004-0595-y
- K. Doll, R. Dovesi, and R. Orlando, Theor. Chem. Acc. 112, 394 (2004). TCACFW 1432-881X 10.1007/s00214-004-0595-y (Pubitemid 40100842)
- (2004) Theoretical Chemistry Accounts , vol.112 , Issue.5-6 , pp. 394-402
- Doll, K.¹ Dovesi, R.² Orlando, R.³

67
- 36149026675
- PHRVAO 0031-899X 10.1103/PhysRev.34.1293
- J. Slater and H. C. Verma, Phys. Rev. 34, 1293 (1929). PHRVAO 0031-899X 10.1103/PhysRev.34.1293
- (1929) Phys. Rev. , vol.34 , pp. 1293
- Slater, J.¹ Verma, H.C.²

68
- 0003685941
- McGraw-Hill, New York
- J. C. Slater, The Self-Consistent Field for Molecular and Solids, Quantum Theory of Molecular and Solids, Vol. 4 (McGraw-Hill, New York, 1974).
- (1974) The Self-Consistent Field for Molecular and Solids, Quantum Theory of Molecular and Solids , vol.4
- Slater, J.C.¹

69
- 26144450583
- PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
- J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981). PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
- (1981) Phys. Rev. B , vol.23 , pp. 5048
- Perdew, J.P.¹ Zunger, A.²

70
- 0000189651
- JCPSA6 0021-9606 10.1063/1.464913
- A. Becke, J. Chem. Phys. 98, 5648 (1993). JCPSA6 0021-9606 10.1063/1.464913
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.¹

71
- 4043178974
- JCPSA6 0021-9606 10.1063/1.1766013
- J. C. Schön, Z. P. Cancarevic, and M. Jansen, J. Chem. Phys. 121, 2289 (2004). JCPSA6 0021-9606 10.1063/1.1766013
- (2004) J. Chem. Phys. , vol.121 , pp. 2289
- Schön, J.C.¹ Cancarevic, Z.P.² Jansen, M.³

72
- 84863360852
- ANCEAD 0044-8249 10.1002/ange.201008070
- K. Doll and M. Jansen, Angew. Chem. 123, 4723 (2011). ANCEAD 0044-8249 10.1002/ange.201008070
- (2011) Angew. Chem. , vol.123 , pp. 4723
- Doll, K.¹ Jansen, M.²

73
- 0000189414
- 10.1103/PhysRevB.48.7903
- J. E. Jaffe and A. C. Hess, Phys. Rev. B 48, 7903 (1993). 10.1103/PhysRevB.48.7903
- (1993) Phys. Rev. B , vol.48 , pp. 7903
- Jaffe, J.E.¹ Hess, A.C.²

74
- 29344468624
- 1-x: A combined experimental and theoretical study
- DOI 10.1016/j.solidstatesciences.2005.08.015, PII S1293255805002268
- T. Homann, U. Hotje, M. Binnewies, A. Borger, K. D. Becker, and T. Bredow, Solid State Sci. 8, 44 (2006). SSSCFJ 1293-2558 10.1016/j. solidstatesciences.2005.08.015 (Pubitemid 43006143)
- (2006) Solid State Sciences , vol.8 , Issue.1 , pp. 44-49
- Homann, T.¹ Hotje, U.² Binnewies, M.³ Borger, A.⁴ Becker, K.-D.⁵ Bredow, T.⁶

75
- 0001401287
- PRBMDO 0163-1829 10.1103/PhysRevB.50.5041
- M. D. Towler, N. L. Allan, N. M. Harrison, V. R. Saunders, W. C. Mackrodt, and E. Aprà, Phys. Rev. B 50, 5041 (1994). PRBMDO 0163-1829 10.1103/PhysRevB.50.5041
- (1994) Phys. Rev. B , vol.50 , pp. 5041
- Towler, M.D.¹ Allan, N.L.² Harrison, N.M.³ Saunders, V.R.⁴ MacKrodt, W.C.⁵ Aprà, E.⁶

76
- 33646452734
- A. M. Ferrari and C. Pisani, J. Phys. Chem. 110, 7909 (2006).
- (2006) J. Phys. Chem. , vol.110 , pp. 7909
- Ferrari, A.M.¹ Pisani, C.²

77
- 84894759199
- See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevB.89.075201 for the basis set information and additional E (V) and H (p) curves.

78
- 0001746944
- JACGAR 0021-8898 10.1107/S0021889898008735
- A. Hannemann, R. Hundt, J. C. Schön, and M. Jansen, J. Appl. Crystallogr. 31, 922 (1998). JACGAR 0021-8898 10.1107/S0021889898008735
- (1998) J. Appl. Crystallogr. , vol.31 , pp. 922
- Hannemann, A.¹ Hundt, R.² Schön, J.C.³ Jansen, M.⁴

79
- 33645158480
- JACGAR 0021-8898 10.1107/S0021889805032450
- R. Hundt, J. C. Schön, and M. Jansen, J. Appl. Crystallogr. 39, 6 (2006). JACGAR 0021-8898 10.1107/S0021889805032450
- (2006) J. Appl. Crystallogr. , vol.39 , pp. 6
- Hundt, R.¹ Schön, J.C.² Jansen, M.³

80
- 84894721918
- (University of Bonn, Germany)
- R. Hundt, KPLOT program-Version 9. 6.15 (University of Bonn, Germany, 2012).
- (2012) KPLOT Program-Version 9. 6.15
- Hundt, R.¹

81
- 43749120253
- VESTA: A three-dimensional visualization system for electronic and structural analysis
- DOI 10.1107/S0021889808012016, PII S0021889808012016
- K. Momma and F. Izumi, J. Appl. Crystallogr. 41, 653 (2008). JACGAR 0021-8898 10.1107/S0021889808012016 (Pubitemid 351693898)
- (2008) Journal of Applied Crystallography , vol.41 , Issue.3 , pp. 653-658
- Momma, K.¹ Izumi, F.²

82
- 80053494854
- PRBMDO 0163-1829 10.1103/PhysRevB.84.094110
- M. P. Molepo and D. P. Joubert, Phys. Rev. B 84, 094110 (2011). PRBMDO 0163-1829 10.1103/PhysRevB.84.094110
- (2011) Phys. Rev. B , vol.84 , pp. 094110
- Molepo, M.P.¹ Joubert, D.P.²

83
- 33645224313
- PRBMDO 0163-1829 10.1103/PhysRevB.70.054104
- S. Limpijumnong and S. Jungthawan, Phys. Rev. B 70, 054104 (2004). PRBMDO 0163-1829 10.1103/PhysRevB.70.054104
- (2004) Phys. Rev. B , vol.70 , pp. 054104
- Limpijumnong, S.¹ Jungthawan, S.²

84
- 70350324607
- ZAACAB 0044-2313 10.1002/zaac.200900260
- J. Frenzel, G. Seifert, and D. Zahn, Z. Anorg. Allg. Chem. 635, 1773 (2009). ZAACAB 0044-2313 10.1002/zaac.200900260
- (2009) Z. Anorg. Allg. Chem. , vol.635 , pp. 1773
- Frenzel, J.¹ Seifert, G.² Zahn, D.³

85
- 80051795760
- 10.1016/j.physb.2011.07.032
- F.-Y. Zhang, Physica. B 406, 3942 (2011). 10.1016/j.physb.2011.07.032
- (2011) Physica. B , vol.406 , pp. 3942
- Zhang, F.-Y.¹

86
- 34247573410
- PRBMDO 0163-1829 10.1103/PhysRevB.75.134109
- J. Cai and N. J. Chen, Phys. Rev. B 75, 134109 (2007). PRBMDO 0163-1829 10.1103/PhysRevB.75.134109
- (2007) Phys. Rev. B , vol.75 , pp. 134109
- Cai, J.¹ Chen, N.J.²

87
- 84865011404
- 10.1021/jp3022375
- D. Zagorac, J. C. Schön, and M. Jansen, J. Phys. Chem. C 116, 16726 (2012). 10.1021/jp3022375
- (2012) J. Phys. Chem. C , vol.116 , pp. 16726
- Zagorac, D.¹ Schön, J.C.² Jansen, M.³

88
- 0033690094
- THSFAP 0040-6090 10.1016/S0040-6090(99)01090-1
- T. Nonaka, G. Ohbayashi, Y. Toriumi, Y. Mori, and H. Hashimoto, Thin Solid Films 370, 258 (2000). THSFAP 0040-6090 10.1016/S0040-6090(99)01090-1
- (2000) Thin Solid Films , vol.370 , pp. 258
- Nonaka, T.¹ Ohbayashi, G.² Toriumi, Y.³ Mori, Y.⁴ Hashimoto, H.⁵

89
- 78149277824
- PRBMDO 0163-1829 10.1103/PhysRevB.82.155209
- P. Fons, A. V. Kolobov, M. Krbal, J. Tominaga, K. S. Andrikopoulos, S. N. Yannopoulos, G. A. Voyiatzis, and T. Uruga, Phys. Rev. B 82, 155209 (2010). PRBMDO 0163-1829 10.1103/PhysRevB.82.155209
- (2010) Phys. Rev. B , vol.82 , pp. 155209
- Fons, P.¹ Kolobov, A.V.² Krbal, M.³ Tominaga, J.⁴ Andrikopoulos, K.S.⁵ Yannopoulos, S.N.⁶ Voyiatzis, G.A.⁷ Uruga, T.⁸

90
- 77957355185
- PRBMDO 0163-1829 10.1103/PhysRevB.82.054121
- G.-S. Do, J. Kim, S.-H. Jhi, C.-H. Park, S. G. Louie, and M. L. Cohen, Phys. Rev. B 82, 054121 (2010). PRBMDO 0163-1829 10.1103/PhysRevB.82.054121
- (2010) Phys. Rev. B , vol.82 , pp. 054121
- Do, G.-S.¹ Kim, J.² Jhi, S.-H.³ Park, C.-H.⁴ Louie, S.G.⁵ Cohen, M.L.⁶

91
- 79961198876
- PRBMDO 0163-1829 10.1103/PhysRevB.84.045206
- D. Zagorac, K. Doll, J. C. Schön, and M. Jansen, Phys. Rev. B 84, 045206 (2011). PRBMDO 0163-1829 10.1103/PhysRevB.84.045206
- (2011) Phys. Rev. B , vol.84 , pp. 045206
- Zagorac, D.¹ Doll, K.² Schön, J.C.³ Jansen, M.⁴

92
- 84865221902
- CEUJED 0947-6539 10.1002/chem.201200180
- D. Zagorac, K. Doll, J. C. Schön, and M. Jansen, Chem. Eur. J. 18, 10929 (2012). CEUJED 0947-6539 10.1002/chem.201200180
- (2012) Chem. Eur. J. , vol.18 , pp. 10929
- Zagorac, D.¹ Doll, K.² Schön, J.C.³ Jansen, M.⁴

93
- 47049118600
- 10.1002/asia.200700323
- Ž. Cancarevic, J. C. Schön, and M. Jansen, Chem. Asian J. 3, 561 (2008). 10.1002/asia.200700323
- (2008) Chem. Asian J. , vol.3 , pp. 561
- Cancarevic, Z.¹ Schön, J.C.² Jansen, M.³

94
- 57649173558
- JPCSAW 0022-3697 10.1016/j.jpcs.2008.09.004
- D. V. Suetin, I. R. Shein, and A. L. Ivanovskii, J. Phys. Chem. Solids 70, 64 (2009). JPCSAW 0022-3697 10.1016/j.jpcs.2008.09.004
- (2009) J. Phys. Chem. Solids , vol.70 , pp. 64
- Suetin, D.V.¹ Shein, I.R.² Ivanovskii, A.L.³

95
- 78149242567
- PRBMDO 0163-1829 10.1103/PhysRevB.82.153408
- B. J. Morgan, Phys. Rev. B 82, 153408 (2010). PRBMDO 0163-1829 10.1103/PhysRevB.82.153408
- (2010) Phys. Rev. B , vol.82 , pp. 153408
- Morgan, B.J.¹

96
- 75749152084
- JAPIAU 0021-8979 10.1063/1.3277053
- J. Wang, P. Xiao, M. Zhou, Z. R. Wang, and F. J. Ke, J. Appl. Phys. 107, 023512 (2010). JAPIAU 0021-8979 10.1063/1.3277053
- (2010) J. Appl. Phys. , vol.107 , pp. 023512
- Wang, J.¹ Xiao, P.² Zhou, M.³ Wang, Z.R.⁴ Ke, F.J.⁵

97
- 84894697681
- D. Zagorac, J. C. Schön, J. Zagorac, and M. Jansen (unpublished)
- D. Zagorac, J. C. Schön, J. Zagorac, and M. Jansen (unpublished).

98
- 0037051623
- 3 and AgO
- DOI 10.1021/ja017845a
- D. Fischer and M. Jansen, J. Am. Chem. Soc. 124, 3488 (2002). JACSAT 0002-7863 10.1021/ja017845a (Pubitemid 34407856)
- (2002) Journal of the American Chemical Society , vol.124 , Issue.14 , pp. 3488-3489
- Fischer, D.¹ Jansen, M.²

99
- 4243434041
- 10.1107/S0365110X65000877
- D. K. Smith, C. F. Cline, and S. B. Austerman, Acta Cryst. 18, 393 (1965). 10.1107/S0365110X65000877
- (1965) Acta Cryst. , vol.18 , pp. 393
- Smith, D.K.¹ Cline, C.F.² Austerman, S.B.³

100
- 0029293262
- SSCOA4 0038-1098 10.1016/0038-1098(95)00054-2
- A. Mang, K. Reimann, and S. Rubenacke, Solid State Commun. 94, 251 (1995). SSCOA4 0038-1098 10.1016/0038-1098(95)00054-2
- (1995) Solid State Commun. , vol.94 , pp. 251
- Mang, A.¹ Reimann, K.² Rubenacke, S.³

101
- 77956614122
- 10.1016/j.apsusc.2010.07.096
- D. Milivojevic, B. Babic-Stojic, and J. Kovac, App. Surf. Sci. 257, 937 (2010). 10.1016/j.apsusc.2010.07.096
- (2010) App. Surf. Sci. , vol.257 , pp. 937
- Milivojevic, D.¹ Babic-Stojic, B.² Kovac, J.³

102
- 84875079419
- 10.1016/j.jallcom.2013.02.040
- K. Siraj, K. Javaid, J. D. Pedarnig, M. A. Bodea, and S. Naseem, J. Alloys Compd. 563, 280 (2013). 10.1016/j.jallcom.2013.02.040
- (2013) J. Alloys Compd. , vol.563 , pp. 280
- Siraj, K.¹ Javaid, K.² Pedarnig, J.D.³ Bodea, M.A.⁴ Naseem, S.⁵

103
- 84867524218
- JAPIAU 0021-8979 10.1063/1.4757023
- S. H. Jang and S. F. Chichibu, J. Appl. Phys. 112, 073503 (2012). JAPIAU 0021-8979 10.1063/1.4757023
- (2012) J. Appl. Phys. , vol.112 , pp. 073503
- Jang, S.H.¹ Chichibu, S.F.²

104
- 0000939615
- 1-xO as a II-VI widegap semiconductor alloy
- DOI 10.1063/1.121384, PII S0003695198042193
- A. Ohtomo, M. Kawasaki, T. Koida, K. Masubuchi, and H. Koinuma, Appl. Phys. Lett. 72, 2466 (1998). APPLAB 0003-6951 10.1063/1.121384 (Pubitemid 128677249)
- (1998) Applied Physics Letters , vol.72 , Issue.19 , pp. 2466-2468
- Ohtomo, A.¹ Kawasaki, M.² Koida, T.³ Masubuchi, K.⁴ Koinuma, H.⁵ Sakurai, Y.⁶ Yoshida, Y.⁷ Yasuda, T.⁸ Segawa, Y.⁹

105
- 33846011101
- Hydrogen multicentre bonds
- DOI 10.1038/nmat1795, PII NMAT1795
- A. Janotti and C. G. Van De Walle, Nat. Mater. 6, 44 (2007). 10.1038/nmat1795 (Pubitemid 46041475)
- (2007) Nature Materials , vol.6 , Issue.1 , pp. 44-47
- Janotti, A.¹ Van De Walle, C.G.²

106
- 0030284421
- THSFAP 0040-6090 10.1016/S0040-6090(96)08923-7
- Y.-S. Choi, C.-C. Lee, and S. M. Cho, Thin Solid Films 289, 153 (1996). THSFAP 0040-6090 10.1016/S0040-6090(96)08923-7
- (1996) Thin Solid Films , vol.289 , pp. 153
- Choi, Y.-S.¹ Lee, C.-C.² Cho, S.M.³

107
- 0001587358
- PRBMDO 0163-1829 10.1103/PhysRevB.53.11425
- H. Karzel, W. Potzel, M. Kofferlein, 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 53, 11425 (1996). PRBMDO 0163-1829 10.1103/PhysRevB.53. 11425
- (1996) Phys. Rev. B , vol.53 , pp. 11425
- Karzel, H.¹ Potzel, W.² Kofferlein, 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

108
- 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. Furthmüller, and F. Bechstedt, Phys. Rev. B 73, 245212 (2006). PRBMDO 0163-1829 10.1103/PhysRevB.73.245212 (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

109
- 0001335880
- 10.1088/0953-8984/8/2/004
- J. C. Schön, H. Putz, and M. Jansen, J. Phys.: Condens. Matter 8, 143 (1996). 10.1088/0953-8984/8/2/004.
- (1996) J. Phys.: Condens. Matter , vol.8 , pp. 143
- Schön, J.C.¹ Putz, H.² Jansen, M.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.