New Method to Calculate the Sign and Relative Strength of Magnetic Interactions in Low-Dimensional Systems on the Basis of Structural Data
arXiv:cond-mat/0504599 · doi:10.1007/s10948-005-0043-9
Abstract
The connection of strength of magnetic interactions and type ordering the magnetic moments with crystal chemical characteristics in low-dimensional magnets is investigated. The new method to calculate the sign and relative strength of magnetic interactions in low-dimensional systems on the basis of the structural data is proposed. This method allows to estimate magnetic interactions not only inside low-dimensional fragments but also between them, and also to predict the possibility of the occurrence of magnetic phase transitions and anomalies of the magnetic interactions. Moreover, it can be used for search of low-dimensional magnets among the compounds whose crystal structures are known. The possibilities of the method are illustrated in an example of research of magnetic interactions in familiar low-dimensional magnets SrCu2(BO3)2, CaCuGe2O6, CaV4O9, Cu2Te2O5Cl2, Cu2Te2O5Br2, BaCu2Si2O7, BaCu2Ge2O7, BaCuSi2O6, LiCu2O2, and NaCu2O2.
18 pages, 8 figures, 2 tables, published version
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- Search of low-dimensional magnetics on the basis of structural data: spin-1/2 antiferromagnetic zigzag chain compounds In2VO5, beta-Sr(VOAsO4)2,(NH4,K)2VOF4 and alpha-ZnV3O8
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- Crystal chemistry search of multiferroics with the stereochemically active lone pair
- Structurally induced magnetic transitions in layered dichalcogenides MoQ2 (Q = S, Se, Te) and double hydroxides (M2+)6Al3(OH)18[Na(H2O)6](SO4)2 6H2O (M2+ = Mn2+, Fe2+) under mechanical deformation