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arXiv:1105.0341 · Physical Review B

Projected wave function study of Z 2 spin liquids on the kagome lattice for the spin- 1 2 quantum Heisenberg antiferromagnet

Yasir Iqbal, Federico Becca, Didier Poilblanc

Published Jul 20, 2011• 172 citations
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Abstract

Motivated by recent density-matrix renormalization group (DMRG) calculations [Yan, Huse, and White, Science 332, 1173 (2011)], which claimed that the ground state of the nearest-neighbor spin-$1/2$ Heisenberg antiferromagnet on the kagome lattice geometry is a fully gapped spin liquid with numerical signatures of ${\mathbb{Z}}_{2}$ gauge structure, and a further theoretical work [Lu, Ran, and Lee, Phys. Rev. B 83, 224413 (2011)], which gave a classification of all Schwinger-fermion mean-field fully symmetric ${\mathbb{Z}}_{2}$ spin liquids on the kagome lattice, we have thoroughly studied Gutzwiller-projected fermionic wave functions by using quantum variational Monte Carlo techniques, hence implementing exactly the constraint of one fermion per site. In particular, we investigated the energetics of all ${\mathbb{Z}}_{2}$ candidates (gapped and gapless) that lie in the neighborhood of the energetically competitive U(1) gapless spin liquids. By using a state-of-the-art optimization method, we were able to conclusively show that the U(1) Dirac state is remarkably stable with respect to all ${\mathbb{Z}}_{2}$ spin liquids in its neighborhood, and in particular for opening a gap toward the so-called ${\mathbb{Z}}_{2}[0,\ensuremath{\pi}]\ensuremath{\beta}$ state, which was conjectured to describe the ground state obtained by the DMRG method. Finally, we also considered the addition of a small second nearest-neighbor exchange coupling of both antiferromagnetic and ferromagnetic type, and obtained similar results, namely, a U(1) Dirac spin-liquid ground state.

DOI
10.1103/physrevb.84.020407

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Due to strong geometric frustration and quantum fluctuation, the S=1/2S=1/2S=1/2 quantum Heisenberg antiferromagnet on the kagome\text{kagome}kagome lattice has long been considered as an ideal platform to realize a spin liquid (SL), a phase exhibiting fractionalized excitations without any symmetry breaking. A recent numerical study (Yan et al., e-print arXiv:1011.6114) of the Heisenberg S=1/2,kagomeS=1/2,\text{kagome}S=1/2,kagome lattice model (HKLM) shows, in contrast to earlier results, that the ground state is a singlet-gapped SL with signatures of Z2{\mathbb{Z}}_{2}Z2​ topological order. Motivated by this numerical discovery, we use the projective symmetry group to classify all 20 possible Schwinger fermion mean-field states of Z2{\mathbb{Z}}_{2}Z2​ SLs on the kagome\text{kagome}kagome lattice. Among them we found only one gapped Z2{\mathbb{Z}}_{2}Z2​ SL (which we call the ${\mathbb{Z}}_{2}[0,\ensuremath{\pi}]\ensuremath{\beta}$ state) in the neighborhood of the U(1) Dirac SL state. Since its parent state, i.e., the U(1) Dirac SL, was found [Ran et al., Phys. Rev. Lett. 98, 117205 (2007)] to be the lowest among many other candidate U(1) SLs, including the uniform resonating-valence-bond states, we propose this ${\mathbb{Z}}_{2}[0,\ensuremath{\pi}]\ensuremath{\beta}$ state to be the numerically discovered SL ground state of the HKLM.
Due to strong geometric frustration and quantum fluctuation, the S = 1/2 quantum Heisenberg antiferromagnet on the kagome lattice has long been considered as an ideal platform to realize a spin liquid (SL), a phase exhibiting fractionalized excitations without any symmetry breaking. A recent numerical study (Yan et al., e-print arXiv:1011.6114) of the Heisenberg S = 1/2, kagome lattice model (HKLM) shows, in contrast to earlier results, that the ground state is a singlet-gapped SL with signatures of Z2 [Z subscript 2] topological order. Motivated by this numerical discovery, we use the projective symmetry group to classify all 20 possible Schwinger fermion mean-field states of Z2 [Z subscript 2] SLs on the kagome lattice. Among them we found only one gapped Z2 [Z subscript 2] SL (which we call the Z2[0,π]β [Z subscript 2 [0,pi] Beta] state) in the neighborhood of the U(1) Dirac SL state. Since its parent state, i.e., the U(1) Dirac SL, was found [Ran et al., Phys. Rev. Lett. 98, 117205 (2007)] to be the lowest among many other candidate U(1) SLs, including the uniform resonating-valence-bond states, we propose this Z2[0,π]β [Z subscript 2 [0,pi] Beta] state to be the numerically discovered SL ground state of the HKLM.
We study the energy and the static spin structure factor of the ground state of the spin-1/21/21/2 quantum Heisenberg antiferromagnetic model on the kagome lattice. By the iterative application of a few Lanczos steps on accurate projected fermionic wave functions and the Green's function Monte Carlo technique, we find that a gapless (algebraic) U(1)U(1)U(1) Dirac spin liquid is competitive with previously proposed gapped (topological) Z2{\mathbb{Z}}_{2}Z2​ spin liquids. By performing a finite-size extrapolation of the ground-state energy, we obtain an energy per site $E/J=\ensuremath{-}0.4365(2)$, which is equal, within three error bars, to the estimates given by the density-matrix renormalization group (DMRG). Our estimate is obtained for a translationally invariant system, and, therefore, does not suffer from boundary effects, like in DMRG. Moreover, on finite toric clusters at the pure variational level, our energies are lower compared to those from DMRG calculations.
In this paper, we do a complete classification of valence-bond crystals (VBCs) on the kagomé lattice based on general arguments of symmetry only and thus identify many new VBCs for different unit cell sizes. For the spin-1/2 Heisenberg antiferromagnet, we study the relative energetics of competing gapless spin liquids (SLs) and VBC phases within the class of Gutzwiller-projected fermionic wave functions using variational Monte Carlo techniques, hence implementing exactly the constraint of one fermion per site. By using a state-of-the-art optimization method, we conclusively show that the U(1) Dirac SL is remarkably stable towards dimerizing into all 6-, 12- and 36-site unit cell VBCs. This stability is also preserved on addition of a next-nearest-neighbor super-exchange coupling of both antiferromagnetic and ferromagnetic (FM) type. However, we find that a 36-site unit cell VBC is stabilized on addition of a very small next-nearest-neighbor FM super-exchange coupling, i.e. | J 2 | ≈ 0.045, and this VBC is the same in terms of space-group symmetry as that obtained in an effective quantum dimer model study. It breaks reflection symmetry, has a nontrivial flux pattern and is a strong dimerization of the uniform RVB SL.
Comment on "Z2Z_{2}Z2​ spin liquid phase on the kagome lattice: a new saddle point", by Tao Li [arXiv:1601.02165 (2016)]
In a recent paper [arXiv:1601.02165], Tao Li claimed that a gapped Z2\mathbb{Z}_2Z2​ spin liquid, obtained using projected Gutzwiller fermionic wave functions, can be stabilized in the Heisenberg model on the kagome lattice. We perform very accurate variational calculations and confirm with unprecedented accuracy the fact, that the Z2\mathbb{Z}_{2}Z2​ spin liquid is a local energy minimum that goes away with system size, thus reaffirming the scenario of a gapless U(1)U(1)U(1) Dirac spin liquid ground state.
By using the variational Monte Carlo technique, we study the spin-12\frac{1}{2}21​ XXZ antiferromagnetic model (with easy-plane anisotropy) on the kagome lattice. A class of Gutzwiller projected fermionic states with a spin Jastrow factor is considered to describe either spin liquids [with U(1)U(1)U(1) or Z2{Z}_{2}Z2​ symmetry] or magnetically ordered phases [with q=(0,0)\mathbf{q}=(0,0)q=(0,0) or $\mathbf{q}=(4\ensuremath{\pi}/3,0)$]. We find that the magnetic states are not stable in the thermodynamic limit. Moreover, there is no energy gain to break the gauge symmetry from U(1)U(1)U(1) to Z2{Z}_{2}Z2​ within the spin-liquid states, as previously found in the Heisenberg model. The best variational wave function is therefore the U(1)U(1)U(1) Dirac state, supplemented by the spin Jastrow factor. Furthermore, a vanishing S=2S=2S=2 spin gap is obtained at the variational level, in the whole regime from the XYXYXY to the Heisenberg model.