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Number of results
2010 | 118 | 5 | 975-977

Article title

DMRG Approach to a Molecular-Based Bimetallic Chain Containing Re(IV) and Cu(II) Ions

Content

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Languages of publication

EN

Abstracts

EN
The bimetallic chain complex [Cu(tren)]ReCl_6 is numerically analysed on the basis of the anisotropic quantum Heisenberg model without the mean-field corrections by the density-matrix renormalization group approach. The high accuracy results of our simulations have been fitted to the corresponding experimental susceptibility data above the crossover regime. The set of model parameters comprising the strength of antiferromagnetic couplings, the single-ion anisotropy term and the corresponding g factors have been found: J/k_{B} = 3.5 ± 0.5 K, D/k_{B} = 35 ± 5 K, g_{Cu} = 2.07 ± 0.05 and g_{Re} = 1.73 ± 0.01.

Keywords

EN

Contributors

author
  • Faculty of Physics, A. Mickiewicz University, Umultowska 85, 61-614 Poznań, Poland
  • Institute of Physics, University of Zielona Góra, Prof. Z. Szafrana 4a, 65-516 Zielona Góra, Poland
author
  • Institute of Engineering and Computer Education, University of Zielona Góra, Prof. Z. Szafrana 4, 65-516 Zielona Góra, Poland
  • Institute of Physics, University of Zielona Góra, Prof. Z. Szafrana 4a, 65-516 Zielona Góra, Poland
author
  • Faculty of Physics, A. Mickiewicz University, Umultowska 85, 61-614 Poznań, Poland
author
  • Faculty of Chemistry, University of Wrocław, F. Joliot-Curie 14, 50-383 Wrocław, Poland
author
  • Faculty of Chemistry, University of Wrocław, F. Joliot-Curie 14, 50-383 Wrocław, Poland

References

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Document Type

Publication order reference

Identifiers

YADDA identifier

bwmeta1.element.bwnjournal-article-appv118n5107kz
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