Neutron Scattering and Magnetic Observables for S = 1/2 Molecular Magnets

2); (2) Physics Division; (3) Department of Chemistry; Astronomy; J.L.Musfeldt (3) ((1) Department of Physics; J.T.Haraldsen (1); Oak Ridge National Laboratory; T.Barnes (1; University of Tennessee; University of Tennessee)

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Neutron Scattering and Magnetic Observables for S = 1/2 Molecular Magnets

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arxiv cond-mat/0408253 v2 pith:65ZMNQXP submitted 2004-08-11 cond-mat.str-el

J.T.Haraldsen (1) , T.Barnes (1 , 2) , J.L.Musfeldt (3) ((1) Department of Physics , Astronomy , University of Tennessee , (2) Physics Division , Oak Ridge National Laboratory

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(3) Department of Chemistry University of Tennessee)

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In this paper we report results for magnetic observables of finite spin clusters composed of S=1/2 ions. We consider clusters of two, three and four spins in distinct spatial arrangements, with isotropic Heisenberg interactions of various strengths between ion pairs. In addition to the complete set of energy eigenvalues and eigenvectors, specific heat and magnetic susceptibility, we also quote results for the single crystal and powder average inelastic neutron scattering structure factors. Examples of the application of these results to experimental systems are also discussed.

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