arXiv subjects

Pontus Laurell

Publications and source records attributed to Pontus Laurell.

32 records · Page 2Linked to original sources

arXiv2021

Spin exchange Hamiltonian and topological degeneracies in elemental gadolinium

We present a comprehensive study of the magnetic exchange Hamiltonian of elemental Gadolinium. We use neutron scattering to measure the magnon spectrum over the entire Brillouin zone, and fit the excitations to a spin wave model to extract the first 26 nearest neighbor magnetic exchange interactions with rigorously defined uncertainty. We find these exchange interactions to follow RKKY behavior, oscillating from ferromagnetic to antiferromagnetic as a function of distance. Finally, we discuss the topological features and degeneracies in Gd, and HCP ferromagnets in general. We show theoretically how, with asymmetric exchange, topological properties could be tuned with a magnetic field.

cond-mat.str-el↗

arXiv2021

Quantifying and controlling entanglement in the quantum magnet Cs$_2$CoCl$_4$

The lack of methods to experimentally detect and quantify entanglement in quantum matter impedes our ability to identify materials hosting highly entangled phases, such as quantum spin liquids. We thus investigate the feasibility of using inelastic neutron scattering (INS) to implement a model-independent measurement protocol for entanglement based on three entanglement witnesses: one-tangle, two-tangle, and quantum Fisher information (QFI). We perform high-resolution INS measurements on Cs$_2$CoCl$_4$, a close realization of the $S=1/2$ transverse-field XXZ spin chain, where we can control entanglement using the magnetic field, and compare with density-matrix renormalization group calculations for validation. The three witnesses allow us to infer entanglement properties and make deductions about the quantum state in the material. We find QFI to be a particularly robust experimental probe of entanglement, whereas the one- and two-tangles require more careful analysis. Our results lay the foundation for a general entanglement detection protocol for quantum spin systems.

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arXiv2021

Witnessing entanglement in quantum magnets using neutron scattering

We demonstrate how quantum entanglement can be directly witnessed in the quasi-1D Heisenberg antiferromagnet KCuF$_3$. We apply three entanglement witnesses --- one-tangle, two-tangle, and quantum Fisher information --- to its inelastic neutron spectrum, and compare with spectra simulated by finite-temperature density matrix renormalization group (DMRG) and classical Monte Carlo methods. We find that each witness provides direct access to entanglement. Of these, quantum Fisher information is the most robust experimentally, and indicates the presence of at least bipartite entanglement up to at least 50 K, corresponding to around 10% of the spinon zone-boundary energy. We apply quantum Fisher information to higher spin-S Heisenberg chains, and show theoretically that the witnessable entanglement gets suppressed to lower temperatures as the quantum number increases. Finally, we outline how these results can be applied to higher dimensional quantum materials to witness and quantify entanglement.

cond-mat.str-el↗

arXiv2020

Exact resummation of the Holstein-Primakoff expansion and differential equation approach to operator square-roots

Operator square-roots are ubiquitous in theoretical physics. They appear, for example, in the Holstein-Primakoff representation of spin operators and in the Klein-Gordon equation. Often the use of a perturbative expansion is the only recourse when dealing with them. In this work we show that under certain conditions differential equations can be derived which can be used to find perturbatively inaccessible approximations to operator square-roots. Specifically, for the number operator $\hat n=\hat a^†a$ we show that the square-root $\sqrt{\hat n}$ near $\hat n=0$ can be approximated by a polynomial in $\hat n$. This result is unexpected because a Taylor expansion fails. A polynomial expression in $\hat n$ is possible because $\hat n$ is an operator, and its constituents $a$ and $a^†$ have a non-trivial commutator $[a,a^†]=1$ and do not behave as scalars. We apply our approach to the zero mass Klein-Gordon Hamiltonian in a constant magnetic field, and as a main application, the Holstein-Primakoff representation of spin operators, where we are able to find new expressions that are polynomial in bosonic operators. We prove that these new expressions exactly reproduce spin operators. Our expressions are manifestly Hermitian, which offer an advantage over other methods, such as the Dyson-Maleev representation.

cond-mat.str-el↗

arXiv2020

Van Hove singularity in the magnon spectrum of the antiferromagnetic quantum honeycomb lattice

The magnetic excitation spectrum of the quantum magnet YbCl$_3$ is studied with inelastic neutron scattering. The spectrum exhibits an unusually sharp feature within a broad continuum, as well as conventional spin waves. By including both transverse and longitudinal channels of the neutron response, linear spin wave theory with a single Heisenberg interaction on the honeycomb lattice reproduces all of the key features in the spectrum. In particular, the broad continuum corresponds to a two-magnon contribution from the longitudinal channel, while the sharp feature within this continuum is identified as a Van Hove singularity in the joint density of states, which indicates the two-dimensional nature of the two-magnon continuum. We term these singularities magneto-caustic features in analogy with caustic features in ray optics where focused envelopes of light are generated when light passes through or reflects from curved or distorted surfaces. The experimental demonstration of a sharp Van Hove singularity in a two-magnon continuum is important because analogous features in potential two-spinon continua could distinguish quantum spin liquids from merely disordered systems. These results establish YbCl$_3$ as a nearly ideal two-dimensional honeycomb lattice material hosting strong quantum effects in the unfrustrated limit.

cond-mat.str-el↗

arXiv2020

Dynamical and thermal magnetic properties of the Kitaev spin liquid candidate $α$-RuCl$_3$

What is the correct low-energy spin Hamiltonian description of $α$-RuCl$_3$? The material is a promising Kitaev spin liquid candidate, but is also known to order magnetically, the description of which necessitates additional interaction terms. The nature of these interactions, their magnitudes and even signs, remain an open question. In this work we systematically investigate dynamical and thermodynamic magnetic properties of proposed effective Hamiltonians. We calculate zero-temperature inelastic neutron scattering (INS) intensities using exact diagonalization, and magnetic specific heat using a thermal pure quantum states method. We find that no single current model satisfactorily explains all observed phenomena of $α$-RuCl$_3$. In particular, we find that Hamiltonians derived from first principles can capture the experimentally observed high-temperature peak in the magnetic specific heat, while overestimating the magnon energy at the zone center. In contrast, other models reproduce important features of the INS data, but do not adequately describe the magnetic specific heat. To address this discrepancy we propose a modified ab initio model that is consistent with both magnetic specific heat and low-energy features of INS data.

cond-mat.str-el↗

arXiv2019

Momentum-space entanglement after a quench in one-dimensional disordered fermionic systems

We numerically investigate the momentum-space entanglement entropy and entanglement spectrum of the random-dimer model and its generalizations, which circumvent Anderson localization, after a quench in the Hamiltonian parameters. The type of dynamics that occurs depends on whether or not the Fermi level of the initial state is near the energy of the delocalized states present in these models. If the Fermi level of the initial state is near the energy of the delocalized states, we observe an interesting slow logarithmic-like growth of the momentum-space entanglement entropy followed by an eventual saturation. Otherwise, the momentum-space entanglement entropy is found to rapidly saturate. We also find that the momentum-space entanglement spectrum reveals the presence of delocalized states in these models for long times after the quench and the many-body entanglement gap decays logarithmically in time when the Fermi level is near the energy of the delocalized states.

cond-mat.str-el↗

arXiv2019

Deriving models for the Kitaev spin-liquid candidate material $α$-RuCl$_3$ from first principles

We use the constrained random phase approximation (cRPA) to derive from first principles the Ru-$t_{2g}$ Wannier function based model for the Kitaev spin-liquid candidate material $α$-RuCl$_3$. We find the non-local Coulomb repulsion to be sizable compared to the local one. In addition we obtain the contribution to the Hamiltonian from the spin-orbit coupling and find it to also contain non-negligible non-local terms. We invoke strong coupling perturbation theory to investigate the influence of these non-local elements of the Coulomb repulsion and the spin-orbit coupling on the magnetic interactions. We find that the non-local Coulomb repulsions cause a strong enhancement of the magnetic interactions, which deviate from experimental fits reported in the literature. Our results contribute to the understanding and design of quantum spin liquid materials via first principles calculations.

cond-mat.str-el↗

arXiv2019

Analogue of Hamilton-Jacobi theory for the time-evolution operator

In this paper we develop an analogue of Hamilton-Jacobi theory for the time-evolution operator of a quantum many-particle system. The theory offers a useful approach to develop approximations to the time-evolution operator, and also provides a unified framework and starting point for many well-known approximations to the time-evolution operator. In the important special case of periodically driven systems at stroboscopic times, we find relatively simple equations for the coupling constants of the Floquet Hamiltonian, where a straightforward truncation of the couplings leads to a powerful class of approximations. Using our theory, we construct a flow chart that illustrates the connection between various common approximations, which also highlights some missing connections and associated approximation schemes. These missing connections turn out to imply an analytically accessible approximation that is the "inverse" of a rotating frame approximation and thus has a range of validity complementary to it. We numerically test the various methods on the one-dimensional Ising model to confirm the ranges of validity that one would expect from the approximations used. The theory provides a map of the relations between the growing number of approximations for the time-evolution operator. We describe these relations in a table showing the limitations and advantages of many common approximations, as well as the new approximations introduced in this paper.

cond-mat.stat-mech↗

arXiv2019

A flow equation approach to periodically driven quantum systems

We present a theoretical method to generate a highly accurate {\em time-independent} Hamiltonian governing the finite-time behavior of a time-periodic system. The method exploits infinitesimal unitary transformation steps, from which renormalization group-like flow equations are derived to produce the effective Hamiltonian. Our tractable method has a range of validity reaching into frequency regimes that are usually inaccessible via high frequency $ω$ expansions in the parameter $h/ω$, where $h$ is the upper limit for the strength of local interactions. We demonstrate our approach on both interacting and non-interacting many-body Hamiltonians where it offers an improvement over the more well-known Magnus expansion and other high frequency expansions. For the interacting models, we compare our approximate results to those found via exact diagonalization. While the approximation generally performs better globally than other high frequency approximations, the improvement is especially pronounced in the regime of lower frequencies and strong external driving. This regime is of special interest because of its proximity to the resonant regime where the effect of a periodic drive is the most dramatic. Our results open a new route towards identifying novel non-equilibrium regimes and behaviors in driven quantum many-particle systems.

cond-mat.stat-mech↗

arXiv2018

Topological Magnon Bands and Unconventional Superconductivity in Pyrochlore Iridate Thin Films

We theoretically study the magnetic properties of pyrochlore iridate bilayer and trilayer thin films grown along the $[111]$ direction using a strong coupling approach. We find the ground state magnetic configurations on a mean field level and carry out a spin-wave analysis about them. In the trilayer case the ground state is found to be the all-in-all-out (AIAO) state, whereas the bilayer has a deformed AIAO state. For all parameters of the spin-orbit coupled Hamiltonian we study, the lowest magnon band in the trilayer case has a nonzero Chern number. In the bilayer case we also find a parameter range with nonzero Chern numbers. We calculate the magnon Hall response for both geometries, finding a striking sign change as function of temperature. Using a slave-boson mean-field theory we study the doping of the trilayer system and discover an unconventional time-reversal symmetry broken $d+id$ superconducting state. Our study complements prior work in the weak coupling limit and suggests that the $[111]$ grown thin film pyrochlore iridates are a promising candidate for topological properties and unconventional orders.

cond-mat.str-el↗

arXiv2018

Magnon thermal Hall effect in kagome antiferromagnets with Dzyaloshinskii-Moriya interactions

We theoretically study magnetic and topological properties of antiferromagnetic kagome spin systems in the presence of both in- and out-of-plane Dzyaloshinskii-Moriya interactions. In materials such as the iron jarosites, the in-plane interactions stabilize a canted noncollinear "umbrella" magnetic configuration with finite scalar spin chirality. We derive expressions for the canting angle, and use the resulting order as a starting point for a spin-wave analysis. We find topological magnon bands, characterized by non-zero Chern numbers. We calculate the magnon thermal Hall conductivity, and propose the iron jarosites as a promising candidate system for observing the magnon thermal Hall effect in a noncollinear spin configuration. We also show that the thermal conductivity can be tuned by varying an applied magnetic field, or the in-plane Dzyaloshinskii-Moriya strength. In contrast with previous studies of topological magnon bands, the effect is found to be large even in the limit of small canting.

cond-mat.str-el↗

arXiv2015

Universal entanglement spectra in critical spin chains

We advocate that in critical spin chains, and possibly in a larger class of 1D critical models, a gap in the momentum-space entanglement spectrum separates the universal part of the spectrum, which is determined by the associated conformal field theory, from the non-universal part, which is specific to the model. To this end, we provide affirmative evidence from multicritical spin chains with low energy sectors described by the SU(2)$_2$ or the SU(3)$_1$ Wess-Zumino-Witten model.

cond-mat.str-el↗

arXiv2014

Thermoelectric properties of Weyl and Dirac semimetals

We study the electronic contribution to the thermal conductivity and the thermopower of Weyl and Dirac semimetals using a semiclassical Boltzmann approach. We investigate the effect of various relaxation processes including disorder and interactions on the thermoelectric properties, and also consider doping away from the Weyl or Dirac point. We find that the thermal conductivity and thermopower have an interesting dependence on the chemical potential that is characteristic of the linear electronic dispersion, and that the electron-electron interactions modify the Lorenz number. For the interacting system, we also use the Kubo formalism to obtain the transport coefficients. We find exact agreement between the Kubo and Boltzmann approaches at high temperatures. We also consider the effect of electric and magnetic fields on the thermal conductivity in various orientations with respect to the temperature gradient. Notably, when the temperature gradient and magnetic field are parallel, we find a large contribution to the longitudinal thermal conductivity that is quadratic in the magnetic field strength, similar to the magnetic field dependence of the longitudinal electrical conductivity due to the presence of the chiral anomaly when no thermal gradient is present.

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