Electronic structure and optical properties of LaNiO3: First-principles calculations

Solid State Communications

Volumn 150, Issue 41-42, 2010, Pages 2011-2014

  Guan, Li ^a   Liu, Baoting ^a   Jin, Litao ^a   Guo, Jianxin ^a   Zhao, Qingxun ^a   Wang, Yinglong ^a   Fu, Guangsheng ^a  

^a HEBEI UNIVERSITY   (China)

Author keywords

A. Metallic nickelate; C. Electronic states; D. Optical properties; E. First principles calculations

Indexed keywords

ABSORPTION COEFFICIENTS; BAND GAPS; C. ELECTRONIC STATES; D. OPTICAL PROPERTIES; E. FIRST-PRINCIPLES CALCULATIONS; ELECTRONIC STRUCTURE AND OPTICAL PROPERTIES; ENERGY RANGES; FIRST PRINCIPLES METHOD; FIRST-PRINCIPLES CALCULATION; INTERBAND; LOWER ENERGIES; NICKELATES; ORDER OF MAGNITUDE; PHOTON ENERGY; REFLECTANCE PEAKS; REFLECTIVITY SPECTRA; TOTAL DENSITY OF STATE;

ELECTRONIC PROPERTIES; ELECTRONIC STATES; ELECTRONIC STRUCTURE; METALLIC COMPOUNDS; REFLECTION;

OPTICAL PROPERTIES;

EID: 77957278688     PISSN: 00381098     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ssc.2010.08.016     Document Type: Article

References (31)

1. C.N.R. Rao, and B. Raveau Transition Metal Oxides 1998 Wiley-Interscience New York
2. I. Chaitanya Lekshmi, Arup Gayen, D.D. Sarma, M.S. Hegde, S.P. Chockalingam, and N. Chandrasekhar J. Appl. Phys. 98 2005 093527
3. J.B. Goodenough, and P. Raccah J. Appl. Phys. 36 1965 1031
4. K. Tsubouchi, I. Ohkubo, H. Kumigashira, Y. Matsumoto, T. Ohnishi, M. Lippmaa, H. Koinuma, and M. Oshima1 Appl. Phys. Lett. 92 2008 262109
5. W. Noun, B. Berini, Y. Dumont, P.R. Dahoo, and N. Keller J. Appl. Phys. 102 2007 063709
6. Kyu-Seog Hwang, Bo-An Kang, Young-Sun Jeon, Jun-Hyung An, Byung-Hoon Kim, Keishi Nishio, and Toshio Tsuchiya Surf. Coat. Technol. 190 2005 331
7. Jan Mistrika, Tomuo Yamaguchi, Daniel Frantab, Ivan Ohlidal, Gu Jin Huc, and Ning Dai Appl. Surf. Sci. 244 2005 431
8. Z.G. Hu, W.W. Li, Y.W. Li, M. Zhu, Z.Q. Zhu, and J.H. Chu Appl. Phys. Lett. 94 2009 221104
9. Z.G. Hu, Z.M. Huang, Y.N. Wu, Q. Zhao, G.S. Wang, and J.H. Chu J. Appl. Phys. 95 2004 4036
10. Noriaki Hamada J. Phys. Chem. Solids 54 1993 1157
11. G. Pari, S.Mathi Jaya, G. Subramoniam, and R. Asokamani Phys. Rev. B 51 1995 16575
12. D.D. Sarma, N. Shanthi, S.R. Barman, N. Hamada, H. Sawada, and K. Terakura Phys. Rev. Lett. 75 1995 1126
13. Igor Solovyev, Noriaki Hamada, and Kiyoyuki Terakura Phys. Rev. B 53 1996 7158
14. J. Son, P. Moetakef, J.M. LeBeau, D. Ouellette, L. Balents, S.J. Allen, and S. Stemmer Appl. Phys. Lett. 96 2010 062114
15. R. Scherwitzl, P. Zubko, C. Lichtensteiger, and J.-M. Triscone Appl. Phys. Lett. 95 2009 222114
16. S.J. May, J.-W. Kim, J.M. Rondinelli, E. Karapetrova, N.A. Spaldin, A. Bhattacharya, and P.J. Ryan Phys. Rev. B 82 2010 014110
17. N. Chaban, M. Weber, S. Pignard, and J. Kreisel Appl. Phys. Lett. 97 2010 031915
18. P. Hansmann, X. Yang, A. Toschi, G. Khaliullin, O.K. Andersen, and K. Held Phys. Rev. Lett. 103 2009 016401
19. R. Eguchi, A. Chainani, M. Taguchi, M. Matsunami, Y. Ishida, K. Horiba, Y. Senba, H. Ohashi, and S. Shin Phys. Rev. B 79 2009 115122
20. M.D. Segall, P.L.D. Lindan, M.J. Probert, C.J. Pickard, P.J. Hasnip, S.J. Clark, and M.C. Payne J. Phys.: Condens. Matter 14 2002 2717
21. D. Vanderbilt Phys. Rev. B 41 1990 7892
22. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
23. M.T. Escote, F.M. Pontes, E.R. Leite, J.A. Varela, R.F. Jardim, and E. Longo Thin Solid Films 54 2003 445
24. M.D. Segall, R. Shah, C.J. Pickard, and M.C. Payne Phys. Rev. B 54 1996 16317
25. A.Yu. Dobin, K.R. Nikolaev, I.N. Krivorotov, R.M. Wentzcovitch, E. Dan Dahlberg, and A.M. Goldman Phys. Rev. B 68 2003 113408
26. J.L. Garcia-Munoz, J. Rodriguez-Carvajal, P. Lacorre, and J.B. Torrance Phys. Rev. B 46 1992 4414
27. C. Kittel Introduction to Solid State Physics seventh ed. 1996 Wiley New York
28. X.Z. Kong, C.X. Liu, W. Dong, X.D. Zhang, C. Tao, L. Shen, J.R. Zhou, Y.F. Fei, and S.P. Ruan Appl. Phys. Lett. 94 2009 123502
29. C. Chang, S.K.R.S. Sankaranarayanan, D. Ruzmetov, M.H. Engelhard, E. Kaxiras, and S. Ramanathan Phys. Rev. B 81 2010 085406
30. J.H. Weaver, and H.P.R. Frederikse Optical Properties of Selected Elements 82nd ed. 2001 CRC Press Boca Raton, FL
31. H. Ehrenreich, H.R. Philipp, and D.J. Olechna Phys. Rev. 131 1963 2469