On the disorder of the Cl atom position in and its probable effect on the magnetic properties of (CuCl)LaNb2O7

Inorganic Chemistry

Volumn 45, Issue 16, 2006, Pages 6227-6234

  Whangbo, Myung Hwan ^a   Dai, Dadi ^a  

^a NORTH CAROLINA STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 33748263409     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic060104w     Document Type: Article

References (25)

1. Kodenkandath, T. A.; Lalena, J. N.; Zhou, W. L.; Carpenter, E. E.; Sangregorio, C.; Falster, A. U.; Simmons, W. B., Jr.; O'Connor, C. J.; Wiley: J. B. J. Am. Chem. Soc. 1999, 121, 10743.
2. Shannon, R. D. Acta Crystallogr. A 1976, 32, 751.
3. Caruntu, G.; Kodenkandath, T. A.; Wiley: J. B. Mater. Res. Bull. 2002, 37, 593.
4. Kageyama, H.; Kitano, T.; Oba, N.; Nishi, M.; Nagai, S.; Hirota, K.; Viciu, L.; Wiley: J. B.; Yasuda, J.; Baba, Y.; Ajiro, Y.; Yoshimura, K. J. Phys. Soc. Jpn. 2005, 74, 1702.
5. Kageyama, H.; Yasuda, J.; Kitano, T.; Totsuda, K.; Narumi, Y.; Hagiwara, M.; Kindo, K.; Baba, Y.; Oba, N.; Ajiro, Y.; Yoshimura, K. J. Phys. Soc. Jpn. 2005, 74, 3155.
6. Goodenough, J. B. Magnetism and the Chemical Bond; Wiley: Cambridge, MA; 1963.
7. Takahashi, M. Phys. Rev. B 1989, 40, 2494.
8. Manousakis, E., Rev. Mod. Phys. 1991, 63, 1.
9. For recent reviews, see: (a) Whangbo, M.-H.; Koo, H.-J.; Dai, D. J. Solid State Chem. 2003, 176, 417.
10. (b) Whangbo, M.-H.; Dai, D.; Koo, H.-J. Solid State Sci. 2005, 7, 827.
11. Clementi, E.; Roetti, C. At. Data Nucl. Data Tables 1974, 14, 177.
12. Our calculations were carried out by employing the SAMOA (Structure and Molecular Orbital Analyzer) program package (Dai, D.; Ren, J.; Liang, W.; Whangbo, M.-H. http://chvamw.chem.ncsu.edu/, 2002).
13. Dai, D.; Whangbo, M.-H. J. Chem. Phys. 2004, 121, 672.
14. Barnes, T. Int. J. Mod. Phys. C 1991, 2, 659.
15. Dagotto, E. Rev. Mod. Phys. 1994, 66, 763.
16. Johnston, D. C.; Kremer, R. K.; Troyer, M.; Wang, X.; Klumper, A.; Bud'ko, S. L.; Panchula, A. F.; Canfield, P. C. Phys. Rev. B 2000, 61, 9558.
17. Quantum Magnetism (Lecture Notes in Physics, Vol. 645); Schollwöck, U., Richter, J., Farnell, D. J. J., Bishop, R. F., Eds.; Springer: New York, 2004.
18. Freiser, M. J. Phys. Rev. 1961, 123, 2003.
19. Wimmer, E. In Density Functional Methods in Chemistry; Labanowski, J. K., Andzelm, J. W., Eds.; Springer-Verlag: New York, 1991; Ch. 2.
20. c)].
21. Kahn, O. Molecular Magnetism: VCH: New York, 1993.
22. Mikeska, H.-J.; Kolezhuk, A. K. In Quantum Magnetism (Lecture Notes in Physics, Vol. 645); Schollwöck, U., Richter, J., Farnell, D. J. J., Bishop, R. F., Eds.; Springer: New York, 2004; Chapter 1.
23. Haldane, F. D. M. Phys. Rev. Lett. 1983, 50, 1153.
24. Richter, J.; Schulenburg, J.; Honecker, A. In Quantum Magnetism (Lecture Notes in Physics, Vol. 645); Schollwöck, U., Richter, J., Farnell, D. J. J., Bishop, R. F., Eds.; Springer: New York, 2004; Chapter 2.
25. Barnes, T.; Dagotto, E.; Riera, J.; Swanson, E. S. Phys. Rev. B 1993, 47, 3196.