arXiv subjects

F. Mila

Publications and source records attributed to F. Mila.

At least 55 records · Page 3Linked to original sources

arXiv2009

Torque anomalies at magnetization plateaux in quantum magnets with Dzyaloshinskii-Moriya interactions

We investigate the effect of Dzyaloshinskii-Moriya (DM) interactions on torque measurements of quantum magnets with magnetization plateaux in the context of a frustrated spin-1/2 ladder. Using extensive DMRG simulations, we show that the DM contribution to the torque is peaked at the critical fields, and that the total torque is non-monotonous if the DM interaction is large enough compared to the g-tensor anisotropy. More remarkably, if the DM vectors point in a principal direction of the g-tensor, torque measurements close to this direction will show well defined peaks even for small DM interaction, leading to a very sensitive way to detect the critical fields. We propose to test this effect in the two-dimensional plateau system SrCu$_2$(BO$_3$)$_2$.

cond-mat.other↗

arXiv2008

Supersolid phases of hardcore bosons on the square lattice: Correlated hopping, next-nearest neighbor hopping and frustration

We discuss the appearance of supersolid phases for interacting hardcore bosons on the square lattice when, in addition to the standard nearest neighbor hopping and repulsion, correlated or next-nearest neighbor hopping is present. Having in mind dimer-based quantum magnets in a field described by effective bosonic models of this kind, we put special emphasis on a comparison between the different cases of relative signs of the kinetic processes, which correspond to unfrustrated or frustrated magnetic models. In the unfrustrated case, we compare Quantum Monte Carlo simulations with a mean-field (classical) approach, which is shown to give qualitatively correct results. Using this classical approach for the frustrated case, we find that the phase diagram is generically richer than in the unfrustrated case. We also investigate in detail the differences between standard next-nearest neighbour and correlated hopping over the diagonal, with the conclusion that both cases are similar if checkerboard order is present at half-filling, while a supersolid phase can be stabilized without any adjacent solid phase only in the case of correlated hopping.

cond-mat.str-el↗

arXiv2008

Magnetization plateaux in an extended Shastry-Sutherland model

We study an extended two-dimensional Shastry-Sutherland model in a magnetic field where besides the usual Heisenberg exchanges of the Shastry-Sutherland model two additional SU(2) invariant couplings are included. Perturbative continous unitary transformations are used to determine the leading order effects of the additional couplings on the pure hopping and on the long-range interactions between the triplons which are the most relevant terms for small magnetization. We then compare the energy of various magnetization plateaux in the classical limit and we discuss the implications for the two-dimensional quantum magnet SrCu$_2$(BO$_3$)$_2$.

cond-mat.str-el↗

arXiv2008

Mechanisms for Spin-Supersolidity in S=1/2 Spin-Dimer Antiferromagnets

Using perturbative expansions and the contractor renormalization (CORE) algorithm, we obtain effective hard-core bosonic Hamiltonians describing the low-energy physics of $S=1/2$ spin-dimer antiferromagnets known to display supersolid phases under an applied magnetic field. The resulting effective models are investigated by means of mean-field analysis and quantum Monte Carlo simulations. A "leapfrog mechanism", through means of which extra singlets delocalize in a checkerboard-solid environment via correlated hoppings, is unveiled that accounts for the supersolid behavior.

cond-mat.str-el↗

arXiv2008

Theory of magnetization plateaux in the Shastry-Sutherland model

Using perturbative continuous unitary transformations, we determine the long-range interactions between triplets in the Shastry-Sutherland model, and we show that an unexpected structure develops at low magnetization with plateaux progressively appearing at 2/9, 1/6, 1/9 and 2/15 upon increasing the inter-dimer coupling. A critical comparison with previous approaches is included. Implications for the compound SrCu$_2$(BO$_3$)$_2$ are also discussed: we reproduce the magnetization profile around localized triplets revealed by NMR, we predict the presence of a 1/6 plateau, and we suggest that residual interactions beyond the Shastry-Sutherland model are responsible for the other plateaux below 1/3.

cond-mat.str-el↗

arXiv2008

First-principles investigation of symmetric and antisymmetric exchange interactions of SrCu$_{2}$(BO$_{3}$)$_{2}$

We report on a first-principles investigation of the electronic structure and of the magnetic properties of the quasi-two-dimensional Mott insulator SrCu$_{2}$(BO$_{3}$)$_{2}$. Based on the hopping integrals and Coulomb interactions calculated with LDA and LSDA+U, we provide a microscopic explanation of the symmetric Heisenberg and antisymmetric Dzyaloshinskii-Moriya exchange integrals of SrCu$_{2}$(BO$_{3}$)$_{2}$. The intra-atomic exchange interaction of oxygen is shown to strongly contribute to the intra-dimer isotropic exchange. The results are in good agreement with those derived from experimental data, both regarding the orientation of the Dzyaloshinskii-Moriya vectors and the magnitude of all exchange integrals. The microscopic analysis is confirmed by the results of Green function's and total energies difference methods.

cond-mat.str-el↗

arXiv2007

Phase separation and flux quantization in the doped quantum dimer model on the square and triangular lattices

The doped two-dimensional quantum dimer model is investigated by numerical techniques on the square and triangular lattices, with significantly different results. On the square lattice, at small enough doping, there is always a phase separation between an insulating valence-bond solid and a uniform superfluid phase, whereas on the triangular lattice, doping leads directly to a uniform superfluid in a large portion of the RVB phase. Under an applied Aharonov-Bohm flux, the superfluid exhibits quantization in terms of half-flux quanta, consistent with Q=2e elementary charge quanta in transport properties.

cond-mat.str-el↗

arXiv2007

Static impurities in the S=3/2 kagome lattice

We consider the effects of doping the S=3/2 kagome lattice with static, nonmagnetic impurities. By exact diagonalization calculations on small clusters we deduce the local spin correlations and magnetization distribution around a vacancy. As in the S=1/2 kagome lattice, in the vicinity of the impurity we find an extended region where the spin correlations are altered as a consequence of frustation relief, and no indications for the formation of local moments. We discuss the implications of our results for local probe measurements on S=3/2 kagome materials.

cond-mat.str-el↗

arXiv2007

Wannier functions and exchange integrals: The example of LiCu$_{2}$O$_{2}$

Starting from a single band Hubbard model in the Wannier function basis, we revisit the problem of the ligand contribution to exchange and derive explicit formulae for the exchange integrals in metal oxide compounds in terms of atomic parameters that can be calculated with constrained LDA and LDA+U. The analysis is applied to the investigation of the isotropic exchange interactions of LiCu$_{2}$O$_{2}$, a compound where the Cu-O-Cu angle of the dominant exchange path is close to 90$^{\circ}$. Our results show that the magnetic moments are localized in Wannier orbitals which have strong contribution from oxygen atomic orbitals, leading to exchange integrals that considerably differ from the estimates based on kinetic exchange only. Using LSDA+U approach, we also perform a direct {\it ab-initio} determination of the exchange integrals LiCu$_{2}$O$_{2}$. The results agree well with those obtained from the Wannier function approach, a clear indication that this modelization captures the essential physics of exchange. A comparison with experimental results is also included, with the conclusion that a very precise determination of the Wannier function is crucial to reach quantitative estimates.

cond-mat.str-el↗

arXiv2006

Single-particle versus pair condensation of hard-core bosons with correlated hopping

We investigate the consequences of correlated hopping on the ground state properties of hard-core bosons on a square lattice as revealed by extensive exact diagonalizations and quantum Monte Carlo simulations. While for non interacting hard-core bosons the effective attraction induced by the correlated hopping leads to phase separation at low density, we show that a modest nearest-neighbor repulsion suppresses phase separation, leading to a remarkable low-density pairing phase with no single particle Bose-Einstein condensation but long-range two-particle correlations, signaling a condensation of pairs. We also explain why the unusual properties of the pairing phase are a real challenge for standard one-worm quantum Monte Carlo simulations.

cond-mat.other↗

arXiv2006

Uniform and staggered magnetizations induced by Dzyaloshinskii-Moriya interactions in isolated and coupled spin 1/2 dimers in a magnetic field

We investigate the interplay of Dzyaloshinskii-Moriya interactions and an external field in spin 1/2 dimers. For isolated dimers and at low field, we derive simple expressions for the staggered and uniform magnetizations which show that the orientation of the uniform magnetization can deviate significantly from that of the external field. In fact, in the limit where the ${\bf D}$ vector of the Dzyaloshinskii-Moriya interaction is parallel to the external field, the uniform magnetization actually becomes {\it perpendicular} to the field. For larger fields, we show that the staggered magnetization of an isolated dimer has a maximum close to one-half the polarization, with a large maximal value of $0.35 gμ_B$ in the limit of very small Dzyaloshinskii-Moriya interaction. We investigate the effect of inter-dimer coupling in the context of ladders with Density Matrix Renormalization Group (DMRG) calculations and show that, as long as the values of the Dzyaloshinskii-Moriya and of the exchange interaction are compatible with respect to the development of a staggered magnetization, the simple picture that emerges for isolated dimers is also valid for weakly coupled dimers with minor modifications. The results are compared with torque measurements on Cu$_{2}$(C$_{5}$H$_{12}$N$_{2}$)$_{2}$Cl$_{4}$.

cond-mat.str-el↗

arXiv2006

Field Induced Staggered Magnetization and Magnetic Ordering in $Cu_2 (C_5 H_{12} N_2)_2 Cl_4$

We present a $^2$D NMR investigation of the gapped spin-1/2 compound $Cu_2 (C_5 H_{12} N_2)_2 Cl_4$. Our measurements reveal the presence of a magnetic field induced transverse staggered magnetization (TSM) which persists well below and above the field-induced 3D long-range magnetically ordered (FIMO) phase. The symmetry of this TSM is different from that of the TSM induced by the order parameter of the FIMO phase. Its origin, field dependence and symmetry can be explained by an intra-dimer Dzyaloshinskii-Moriya interaction, as shown by DMRG calculations on a spin-1/2 ladder. This leads us to predict that the transition into the FIMO phase is not in the BEC universality class.

cond-mat.str-el↗

arXiv2006

The emergence of Resonating Valence Bond physics in spin-orbital models

We discuss how orbital degeneracy, which is usually removed by a cooperative Jahn-Teller distortion, could under appropriate circumstances lead rather to a Resonating Valence Bond spin-orbital liquid. The key points are: i) The tendency to form spin-orbital dimers, a tendency already identified in several cases; ii) The mapping onto Quantum Dimer Models, which have been shown to possess Resonating Valence Bond phases on the triangular lattice. How this program can be implemented is explained in some details starting from a microscopic model of LiNiO$_2$.

cond-mat.str-el↗

arXiv2006

Plaquette valence bond solid in the frustrated Heisenberg quantum antiferromagnet on the square lattice

Using both exact diagonalizations and diagonalizations in a subset of short-range valence bond singlets, we address the nature of the groundstate of the Heisenberg spin-1/2 antiferromagnet on the square lattice with competing next-nearest and next-next-nearest neighbor antiferromagnetic couplings (J1-J2-J3 model). A detailed comparison of the two approaches reveals a region along the line (J2+J3)/J1=1/2, where the description in terms of nearest-neighbor singlet coverings is excellent, therefore providing evidence for a magnetically disordered region. Furthermore a careful analysis of dimer-dimer correlation functions, dimer structure factors and plaquette-plaquette correlation functions provides striking evidence for the presence of a plaquette valence bond solid order in part of the magnetically disordered region.

cond-mat.str-el↗

arXiv2006

The quadrupolar phases of the S=1 bilinear-biquadratic Heisenberg model on the triangular lattice

Using mean-field theory, exact diagonalizations and SU(3) flavour theory, we have precisely mapped out the phase diagram of the S=1 bilinear-biquadratic Heisenberg model on the triangular lattice in a magnetic field, with emphasis on the quadrupolar phases and their excitations. In particular, we show that ferroquadrupolar order can coexist with short-range helical magnetic order, and that the antiferroquadrupolar phase is characterized by a remarkable 2/3 magnetization plateau, in which one site per triangle retains quadrupolar order while the other two are polarized along the field. Implications for actual S=1 magnets are discussed.

cond-mat.str-el↗

arXiv2006

Exotic phenomena in doped quantum magnets

We investigate the properties of the two-dimensional frustrated quantum antiferromagnet on the square lattice, especially at infinitesimal doping. We find that next nearest neighbor (N.N.) J2 and next-next N.N. J3 interactions together destroy the antiferromagnetic long range order and stabilize a quantum disordered valence bond crystalline plaquette phase. A static vacancy or a dynamic hole doped into this phase liberates a spinon. From the profile of the spinon wavefunction around the (static) vacancy we identify an intermediate behavior between complete deconfinement (behavior seen in the kagome lattice) and strong confinement (behavior seen in the checkerboard lattice) with the emergence of two length scales, a spinon confinement length larger than the magnetic correlation length. When a finite hole hopping is introduced, this behavior translates into an extended (mobile) spinon-holon boundstate with a very small quasiparticle weight. These features provide clear evidence for a nearby "deconfined critical point" in a doped microscopic model. Finally, we give arguments in favor of superconducting properties of the doped plaquette phase.

cond-mat.str-el↗

arXiv2006

Checkerboard order in the t--J model on the square lattice

We propose that the inhomogeneous patterns seen by STM in some underdoped superconducting cuprates could be related to a bond-order-wave instability of the staggered flux state, one of the most studied "normal" state proposed to compete with the d-wave RVB superconductor. A checkerboard pattern is obtained by a Gutzwiller renormalized mean-field theory of the t-J model for doping around 1/8. It is found that the charge modulation is always an order of magnitude smaller than the bond-order modulations. This is confirmed by an exact optimization of the wavefunction by a variational Monte Carlo scheme. The numerical estimates of the order parameters are however found to be strongly reduced w.r.t their mean-field values.

cond-mat.str-el↗

arXiv2006

Condensation of magnons and spinons in a frustrated ladder

Motivated by the ever-increasing experimental effort devoted to the properties of frustrated quantum magnets in a magnetic field, we present a careful and detailed theoretical analysis of a one-dimensional version of this problem, a frustrated ladder with a magnetization plateau at m=1/2. We show that even for purely isotropic Heisenberg interactions, the magnetization curve exhibits a rather complex behavior that can be fully accounted for in terms of simple elementary excitations. The introduction of anisotropic interactions (e.g., Dzyaloshinskii-Moriya interactions) modifies significantly the picture and reveals an essential difference between integer and fractional plateaux. In particular, anisotropic interactions generically open a gap in the region between the plateaux, but we show that this gap closes upon entering fractional plateaux. All of these conclusions, based on analytical arguments, are supported by extensive Density Matrix Renormalization Group calculations.

cond-mat.str-el↗