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Journal of Physics Condensed Matter

Theory of the orthogonal dimer Heisenberg spin model for SrCu 2 (BO 3 ) 2

Shin Miyahara, Kazuo Ueda

Published Feb 24, 2003• 248 citations
Publisher

Abstract

The magnetic properties of SrCu 2 (BO 3 ) 2 are reviewed from a theoretical point of view. SrCu 2 (BO 3 ) 2 is a new two-dimensional spin gap system and its magnetic properties are well described by a spin-1/2 antiferromagnetic Heisenberg model of the orthogonal dimer lattice. The model has a dimer singlet ground state whose exactness was proven by Shastry and Sutherland for a topologically equivalent model more than 20 years ago. The exactness of the ground state is maintained even if interlayer couplings are introduced for SrCu 2 (BO 3 ) 2 . In the two-dimensional model, quantum phase transitions take place between different ground states for which three phases are expected: a gapped dimer singlet state, a plaquette resonating valence bond state and a gapless magnetic ordered state. Analysis of the experimental data shows that the dimer singlet ground state is realized in SrCu 2 (BO 3 ) 2 . The orthogonality of the dimer bonds, which is the underlying symmetry of the exactness of the ground state, also leads to an unusual property of elementary excitations, namely the almost localized nature of the triplet excitations. Application of an external magnetic field changes the density of the triplet excitations. In general, there is competition between kinetic energies and interaction energies between triplets. The almost localized nature of the triplets makes it easy to form regular lattices. In fact, at certain densities, where the commensurability energy is significant, the triplet excitations form superstructures and plateaux appear at 1/2, 1/3, 1/4 and 1/8 in the magnetization curve. In high-magnetic-field experiments, magnetic plateaux at magnetizations of 1/3, 1/4 and 1/8 have been observed. Translational symmetry of the lattice is spontaneously broken at the plateaux, except for the 1/2 plateau. The 1/3 and 1/4 plateaux are expected to have magnetic superstructures of stripe form while the 1/2 plateau has a square unit cell and the 1/8 plateau a rhomboid cell. Especially at the 1/8 plateau, nuclear magnetic resonance experiments indicate the presence of at least 11 distinct Cu sites with different spin polarizations, which is the first evidence of breaking of the translational symmetry at the plateau phase. The spin texture calculated on the basis of a Heisenberg model with adiabatic spin–phonon coupling is consistent with the experimental results.

DOI
10.1088/0953-8984/15/9/201

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The magnetic properties of SrCu 2 (BO 3 ) 2 are reviewed from a theoretical point of view. SrCu 2 (BO 3 ) 2 is a new two-dimensional spin gap system and its magnetic properties are well described by a spin-1/2 antiferromagnetic Heisenberg model of the orthogonal dimer lattice. The model has a dimer singlet ground state whose exactness was proven by Shastry and Sutherland for a topologically equivalent model more than 20 years ago. The exactness of the ground state is maintained even if interlayer couplings are introduced for SrCu 2 (BO 3 ) 2 . In the two-dimensional model, quantum phase transitions take place between different ground states for which three phases are expected: a gapped dimer singlet state, a plaquette resonating valence bond state and a gapless magnetic ordered state. Analysis of the experimental data shows that the dimer singlet ground state is realized in SrCu 2 (BO 3 ) 2 . The orthogonality of the dimer bonds, which is the underlying symmetry of the exactness of the ground state, also leads to an unusual property of elementary excitations, namely the almost localized nature of the triplet excitations. Application of an external magnetic field changes the density of the triplet excitations. In general, there is competition between kinetic energies and interaction energies between triplets. The almost localized nature of the triplets makes it easy to form regular lattices. In fact, at certain densities, where the commensurability energy is significant, the triplet excitations form superstructures and plateaux appear at 1/2, 1/3, 1/4 and 1/8 in the magnetization curve. In high-magnetic-field experiments, magnetic plateaux at magnetizations of 1/3, 1/4 and 1/8 have been observed. Translational symmetry of the lattice is spontaneously broken at the plateaux, except for the 1/2 plateau. The 1/3 and 1/4 plateaux are expected to have magnetic superstructures of stripe form while the 1/2 plateau has a square unit cell and the 1/8 plateau a rhomboid cell. Especially at the 1/8 plateau, nuclear magnetic resonance experiments indicate the presence of at least 11 distinct Cu sites with different spin polarizations, which is the first evidence of breaking of the translational symmetry at the plateau phase. The spin texture calculated on the basis of a Heisenberg model with adiabatic spin–phonon coupling is consistent with the experimental results.
The two dimensional Heisenberg model for SrCu2(BO3)2{\mathrm{SrCu}}_{2}({\mathrm{BO}}_{3}{)}_{2}SrCu2​(BO3​)2​ has an exact dimer ground state which was proven by Shastry and Sutherland almost twenty years ago. The critical value of the quantum phase transition from the dimer state to the N\'eel ordered state is determined. Analysis of the experimental data shows that SrCu2(BO3)2\mathrm{SrCu}{}_{2}(\mathrm{BO}{}_{3}{)}_{2}SrCu2​(BO3​)2​ has the dimer ground state but its coupling constants are close to the transition point, which leads to an unusual temperature dependence of the susceptibility. The almost localized nature of the triplet excitations explains the plateaus observed in the magnetization curve.
SrCu 2( BO 3)2 is a new two-dimensional spin gap system and the magnetic behaviour of this compound is explained well by the two-dimensional orthogonal dimer Heisenberg model. Recently several excitations have been observed by inelastic neutron scattering and other experiments. We study features of these excitations by Lanczos method and perturbation technique. A triplet excitation has an almost localised nature. This localised character is observed as an almost flat band in neutron scattering. On the other hand, bound states of two triplet excitations, which have dispersive character, are stable in contrast to ordinary magnetic systems. We calculate the dynamic structure factor by a Lanczos method in finite systems and compare our results with experiments.
High-pressure and high-field electron spin resonance (ESR) measurements have been performed on a single crystal of the orthogonal-dimer spin system SrCu2_{2}2​(BO3_{3}3​)2_{2}2​. With frequencies below 1 THz, ESR signals associated with transitions from the singlet ground state to the one-triplet excited states and the two-triplet bound state were observed at pressures up to 2.1 GPa. We obtained directly the pressure dependence of the gap energies, finding a clear first-order phase transition at Pc=1.85±0.05P_{c}=1.85\pm0.05Pc​=1.85±0.05 GPa. By comparing this pressure dependence with the calculated excitation energies obtained from an exact diagonalization, we determined the precise pressure dependence for inter- (J′J'J′) and intra-dimer (JJJ) exchange interactions considering the Dzyaloshinski-Moriya interaction. Thus this system undergoes a first-order quantum phase transition from the dimer singlet phase to a plaquette singlet phase above the ratio (J′/J)c=0.660±0.003(J'/J)_{c}=0.660\pm0.003(J′/J)c​=0.660±0.003.
By using the perturbation expansion up to the fifth order, we study the two-triplet-dimer excitation spectra in the Shastry-Sutherland model, where the localized nature of a triplet-dimer, the propagation of a triplet-dimer pair by the correlated hopping and the long-range interactions between triplet-dimers play an essential role. It is found that the dispersion relations for first-neighbor triplet-dimer pair excitations with S=1 and p-type symmetry qualitatively explain the second-lowest branch observed in the neutron inelastic scattering experiment. It is also predicted that the second-lowest branch consists of two components, p_x- and p_y-states, with slightly different excitation energies. The origin of the singlet mode at 3.7meV observed in the Raman scattering experiment is also discussed.
Recent advances in the orthogonal-dimer spin-Heisenberg antiferromagnet are reviewed. This model has been examined for more than 40 years since it was originally studied by Shastry and Sutherland. The discovery of SrCu(BO)as a good candidate material for thesystem led to a considerable advancement in subsequent research. In the case whenis larger than 1/2, however, the elucidation of the properties of the system was relatively delayed. In the ground state of general-systems, interesting quantum phase transitions occur not only for. In this article, the systematic behavior depending onwhich has been recently clarified by unbiased and numerical computational calculations is reviewed. The effects due to spin anisotropy as determined from experimental and theoretical results are also overviewed. We also mention recent developments for thesystem.
Spin-1/2 Heisenberg model on the Shastry-Sutherland lattice is considered within the many-body perturbation theory developed from the exactly solved spin-1/2 Ising-Heisenberg model with the Heisenberg intradimer and Ising interdimer interactions. The former model is widely used for a description of magnetic properties of the layered compound SrCu _2 2 (BO _3 3 ) _2 2 , which exhibits a series of fractional magnetization plateaux at sufficiently low temperatures. Using the novel type of many-body perturbation theory we have found the effective model of interacting triplet excitations with the extended hard-core repulsion, which accurately recovers 1/8, 1/6 and 1/4 magnetization plateaux for moderate values of the interdimer coupling. A possible existence of a striking quantum phase of bound triplons is also revealed at low enough magnetic fields.