Electronic structure study of NaCo2O4 by LAPW method

Physica B: Condensed Matter

Volumn 391, Issue 2, 2007, Pages 389-392

  Xu, Ying ^a   Zeng, Zhi ^b  

^a JIANGXI NORMAL UNIVERSITY   (China)

^b INSTITUTE OF SOLID STATE PHYSICS   (China)

Author keywords

Electric field gradient (EFG); Electronic structure; Fist principle

Indexed keywords

CRYSTAL STRUCTURE; ELECTRIC FIELDS; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE;

ELECTRIC FIELD GRADIENT (EFG); FIST PRINCIPLE; LINEARIZED AUGMENTED PLANE WAVE (LAPW) METHOD; VIRTUAL CRYSTAL APPROXIMATION;

SODIUM COMPOUNDS;

EID: 33847141082     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2006.10.024     Document Type: Article

References (12)

1. Terasaki I., Sasago Y., and Uchinokura K. Phys. Rev. B 56 (1997) 12685
2. Tanaka T., Nakamura S., and Iida S. Jpn. J. Appl. Phys 33 (1994) L581 Part 2, Na4B
3. Jansen V.M., and Hoppe R. Z. Anorg. Allg. Chem 408 (1974) 104
4. Ray R., Ghoshray A., and Ghoshray K. Phys. Rev. B 59 (1999) 9454
5. Singh D.J. Phys. Rev. B 61 (2000) 13397
6. Motohashi T., Ueda R., Naujalis E., Tojo T., Terasaki I., Atake T., Karppinen M., and Yamauchi H. Phys. Rev. B 67 (2003) 064406
7. Y. Ando, N. Miyamoto, Kouji Segawa, T. Kawata, I. Terasaki, cond-mat 9907008.
8. P. Blaha, K. Schwarz, G.K.H. Madsen, D. Kvasnicka, J. Luitz, WIEN2k, Vienna University of Technology An Augmented Plane Wave+Local Orbitals Program for Calculating Crystal Properties revised edition 2001.
9. Perdew J.P., Burke S., and Ernzerhof M. Phys. Rev. Lett. 77 (1996) 3685
10. Anisimov V.I., Aryasetiawan F., and Lichtenstein A.I. J. Phys.: Condens. Matter 9 (1997) 767
11. In: Diechi P., Fluck E., Gunther H., Kosfeld R., and Seeling J. (Eds). NMR 31, Solid-State NMR II Inorganic Matter (1994), Springer, Berlin
12. Blaha P., and schwarz K. Phy. Rev. Lett. 54 (1985) 1192