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http://dx.doi.org/10.5012/bkcs.2008.29.1.122

Determination of Strongly Interacting Spin Exchange Paths in Cu2(O3PCH2PO3) on the Basis of Spin Dimer Analysis  

Bae, Hyun-Woo (Department of Chemistry and Research Institute of Basic Science of Kyung Hee University)
Koo, Hyun-Joo (Department of Chemistry and Research Institute of Basic Science of Kyung Hee University)
Publication Information
Bulletin of the Korean Chemical Society / v.29, no.1, 2008 , pp. 122-126 More about this Journal
Abstract
The magnetic properties of the organic/inorganic hybrid copper-methylenediphosphonate, Cu2(O3PCH2PO3) were examined by performing the spin dimer analysis based on the extended Hckel tight binding method. In Cu2(O3PCH2PO3) the CuO3 chains made up of edge-sharing CuO5 square pyramidal units are inter-linked by O-P-O bridges. The Cu-O-Cu superexchange interactions of the CuO3 chains are negligibly weak compared with the Cu-O…O-Cu super-superexchange interactions that occur between the CuO3 chains. The spin exchange interactions of Cu2(O3PCH2PO3) are dominated by three super-superexchange interactions, which leads to a three-dimensional antiferromagnetic spin lattice. The strongest spin exchange interactions form isolated spin dimers, which suggests that, to a first approximation, the magnetic properties can be described in terms of an isolated spin dimer model.
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1 Belik, A. A.; Azuma, M.; Matsuo, A.; Whangbo, M.-H.; Koo, H.-J.; Kikuchi, J.; Kaji, T.; Okubo, S.; Ohta, H.; Kindo, K.; Takano, M. Inorg. Chem. 2005, 44, 6632   DOI   ScienceOn
2 Koo, H.-J.; Whangbo, M.-H. Inorg. Chem. 2006, 45, 4440   DOI   ScienceOn
3 Koo, H.-J.; Dai, D.; Whangbo, M.-H. Inorg. Chem. 2005, 44, 4359   DOI   ScienceOn
4 Koo, H.-J.; Whangbo, M.-H. J. Solid State Chem. 2000, 151, 96   DOI   ScienceOn
5 Hoffmann, R. J. Chem. Phys. 1963, 39, 1397   DOI
6 Dai, D.; Whangbo, M.-H.; Koo, H.-J.; Rocquefelte, X.; Jobic, S.; Villesuzanne, A. Inorg. Chem. 2005, 44, 2407   DOI   ScienceOn
7 Koo, H.-J.; Lee, C.; Wilson-Short, G. B.; Dai, D.; Whangbo, M.-H. Inorg. Chem. 2007, 46, 2498   DOI   ScienceOn
8 Goodenough, J. B. Magnetism and the Chemical Bond; Wiley: Cambridge, MA, 1963
9 Whangbo, M.-H.; Koo, H.-J.; Lee, K.-S. Solid State Commun. 2000, 114, 77
10 Burkholder, E.; Golub, V. O.; O'Connor, C. J.; Zubieta, J. Inorg. Chim. Acta 2002, 340, 127   DOI   ScienceOn
11 Whangbo, M.-H.; Koo, H.-J.; Dai, D. J. Solid State Chem. 2003, 176, 417   DOI   ScienceOn
12 Koo, H.-J.; Whangbo, M.-H. Inorg. Chem. 2001, 40, 2169
13 Koo, H.-J.; Whangbo, M.-H.; VerNooy, P. D.; Torardi, C. C.; Marshall, W. J. Inorg. Chem. 2002, 41, 4664   DOI   ScienceOn
14 Whangbo, M.- H.; Koo, H.-J.; Dai, D.; Jung, D. Inorg. Chem. 2003, 42, 3898   DOI   ScienceOn
15 Koo, H.-J.; Whangbo, M.-H.; Lee, K.-S. Inorg. Chem. 2003, 42, 5932   DOI   ScienceOn
16 Wang, J. D.; Clearfield, A.; Peng, G.-Z. Mater. Chem. Phys. 1993, 35, 208   DOI   ScienceOn
17 Stein, E.; Clearfield, A.; Subramanian, M. A. Solid State Ion 1996, 83, 113   DOI   ScienceOn
18 Johnston, D. C.; Kremer, R. K.; Troyer, M.; Wang, X.; Klümper, A.; Bud'ko, S. L.; Panchula, A. F.; Canfield, P. C. Phys. Rev. B 2000, 61, 9558   DOI   ScienceOn
19 Vermeulen, L. A.; Snover, J. L.; Sapochak, L. S.; Thompson, M. E. J. Am. Chem. Soc. 1993, 115, 11767   DOI   ScienceOn
20 Ueda, Y. Chem. Mater. 1998, 10, 2653   DOI   ScienceOn
21 Vasil'ev, A. N.; Markina, M. M.; Popova, E. A. Low Temp. Phys. 2005, 31, 203   DOI   ScienceOn
22 Bleaney, B.; Bowers, K. D. Proc. R. Soc. London, Ser. A 1952, 214, 451   DOI
23 Nakajima, T.; Mitamura, H.; Ueda, Y. J. Phys. Soc. Jpn 2006, 75, 54706   DOI   ScienceOn
24 Koo, H.-J.; Lee, K.-S.; Whangbo, M.-H. Inorg. Chem. 2006, 45, 10743   DOI   ScienceOn
25 Kahn, O. Molecular Magnetism; VCH Publisher: Weinheim, 1993
26 Hay, P. J.; Thibeault, J. C.; Hoffmann, R. J. Am. Chem. Soc. 1975, 97, 4884   DOI
27 http://chvamw.chem.ncsu.edu/
28 Clementi, E.; Roetti, C. Atomic Data Nuclear Data Tables 1974, 14, 177   DOI
29 Whangbo, M.-H.; Dai, D.; Koo, H.-J. Solid State Sci. 2005, 7, 827   DOI   ScienceOn