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Jeroen van den Brink

Publications and source records attributed to Jeroen van den Brink.

At least 181 records · Page 10Linked to original sources

Phonon-mediated Casimir interaction between finite mass impurities

The Casimir effect, a two-body interaction via vacuum fluctuations, is a fundamental property of quantum systems. In solid state physics it emerges as a long-range interaction between two impurity atoms via virtual phonons. In the classical limit for the impurity atoms in $D$ dimensions the interaction is known to follow the universal power-law $U(r)\sim r^{-D}$. However, for finite masses of the impurity atoms on a lattice, it was predicted to be $U(r)\sim r^{-2D-1}$ at large distances. We examine how one power-law can change into another with increase of the impurity mass and in presence of an external potential. We provide the exact solution for the system in one-dimension. At large distances indeed $U(r)\sim r^{-3}$ for finite impurity masses, while for the infinite impurity masses or in an external potential it crosses over to $U(r)\sim r^{-1}$ . At short distances the Casimir interaction is not universal and depends on the impurity mass and the external potential.

cond-mat.quant-gas↗

Prediction of a magnetic Weyl semimetal without spin-orbit coupling and strong anomalous Hall effect in the Heusler compensated ferrimagnet Ti2MnAl

We predict a magnetic Weyl semimetal in the inverse Heusler Ti2MnAl, a compensated ferrimagnet with a vanishing net magnetic moment and a Curie temperature of over 650 K. Despite the vanishing net magnetic moment, we calculate a large intrinsic anomalous Hall effect (AHE) of about 300 S/cm. It derives from the Berry curvature distribution of the Weyl points, which are only 14 meV away from the Fermi level and isolated from trivial bands. Different from antiferromagnets Mn3X (X= Ge, Sn, Ga, Ir, Rh, and Pt), where the AHE originates from the non-collinear magnetic structure, the AHE in Ti2MnAl stems directly from the Weyl points and is topologically protected. The large anomalous Hall conductivity (AHC) together with a low charge carrier concentration should give rise to a large anomalous Hall angle. In contrast to the Co-based ferromagnetic Heusler compounds, the Weyl nodes in Ti2MnAl do not derive from nodal lines due to the lack of mirror symmetries in the inverse Heusler structure. Since the magnetic structure breaks spin-rotation symmetry, the Weyl nodes are stable without SOC. Moreover, because of the large separation between Weyl points of opposite topological charge, the Fermi arcs extent up to 75% of the reciprocal lattice vectors in length. This makes Ti2MnAl an excellent candidate for the comprehensive study of magnetic Weyl semimetals. It is the first example of a material with Weyl points, large anomalous Hall effect and angle despite a vanishing net magnetic moment.

cond-mat.mtrl-sci↗

Fluctuation-induced Néel and Bloch skyrmions at topological insulator surfaces

Ferromagnets in contact with a topological insulator have become appealing candidates for spintronics due to the presence of Dirac surface states with spin-momentum locking. Because of this bilayer Bi$_2$Se$_3$-EuS structures, for instance, show a finite magnetization at the interface at temperatures well exceeding the Curie temperature of bulk EuS. Here we determine theoretically the effective magnetic interactions at a topological insulator-ferromagnet interface {\it above} the magnetic ordering temperature. We show that by integrating out the Dirac fermion fluctuations an effective Dzyaloshinskii-Moriya interaction and magnetic charging interaction emerge. As a result individual magnetic skyrmions and extended skyrmion lattices can form at interfaces of ferromagnets and topological insulators, the first indications of which have been very recently observed experimentally.

cond-mat.mtrl-sci↗

Polytypism at its best: improved thermoelectric performance in Li based Nowotony-Juza phases

In principle thermoelectricity is a viable route of converting waste heat into electricity, but the commercialization of the technology is limited by its present efficiency. In quest of improved materials, utilizing an \textit{ab initio} approach, we report polytypism induced improved thermoelectric performance in Li based Nowotny-Juza phases LiZn\textit{X} (\textit{X} = N, P, As, Sb, and Bi). In addition to LiZnSb, we find that cubic LiZnBi is energetically more favorable than the hitherto explored hexagonal phase whereas the hexagonal polytypes of cubic LiZnP, and LiZnAs are likely to be stabilized by pressure -- hydrostatic pressure can be aided by internal pressure to facilitate the phase transition. We find a pronounced impact of the polytypism on thermoelectric properties. We determine conservative estimates of the figure of merit and find that while power factor and figure of merit values are improved in hexagonal phases, the values in cubic phases are still excellent. The \textit{ZT} values of cubic and hexagonal LiZnSb at 700 K are 1.27 and 1.95, respectively. Other promising \textit{ZT} values at 700 K are 1.96 and 1.49 of hexagonal LiZnP and LiZnAs, respectively, for \textit{n}-type doping. Overall, our findings proffers that the Nowotny-Juza phases are a new potential class of thermoelectric materials.

cond-mat.mtrl-sci↗

Strong spin-Hall and Nernst effects in a p-band semimetal

Since spin currents can be generated, detected, and manipulated via the spin Hall effect (SHE), the design of strong SHE materials has become a focus in the field of spintronics. Because of the recent experimental progress also the spin Nernst effect (SNE), the thermoelectrical counterpart of the SHE, has attracted much interest. Empirically strong SHEs and SNEs are associated with $d$-band compounds, such as transition metals and their alloys -- the largest spin Hall conductivity (SHC) in a $p$-band material is $\sim 450$ $\left(\hbar/e\right)\left(Ω\cdot cm\right)^{-1}$ for a Bi-Sb alloy, which is only about a fifth of platinum. This raises the question whether either the SHE and SNE are naturally suppressed in $p$-bands compounds, or favourable $p$-band systems were just not identified yet. Here we consider the $p$-band semimetal InBi, and predict it has a record SHC $σ_{xy}^{z}\approx 1100 \ \left(\hbar/e\right)\left(Ω\cdot cm\right)^{-1}$ which is due to the presence of nodal-lines in its band structure. Also the spin-Nernst conductivity $α_{zx}^y\approx 1.2 \ (\hbar/e)(A/m\cdot K)$ is very large, but our analysis shows its origin is different as the maximum appears in a different tensor element. This insight gained on InBi provides guiding principles to obtain a strong SHE and SNE in $p$-band materials and establishes a more comprehensive understanding of the relationship between the SHE and SNE.

cond-mat.mtrl-sci↗

Photogalvanic Effect in Weyl Semimetals from First Principles

Using first-principles calculations, we investigate the photogalvanic effect in the Weyl semimetal material TaAs. We find colossal photocurrents caused by the Weyl points in the band structuure in a wide range of laser frequency. Our calculations reveal that the photocurrent is predominantly contributed by the three-band transition from the occupied Weyl band to the empty Weyl band via an intermediate band away from the Weyl cone, for excitations both by linearly and circularly polarized lights. Therefore, it is significant to sum over all three-band transitions by considering a full set of Bloch bands (both Weyl bands and trivial bands) in the first-principles band structure while it does not suffice to only consider the two-band direct transition within a Weyl cone. Calculated photoconductivities are well consistent with recent experiment measurements. Our work provides the first first-principles calculation on nonlinear optical phenomena of Weyl semimetals and serves as a deep understanding of the photogalvanic effects in complexed materials.

cond-mat.str-el↗

Electrically tuneable nonlinear anomalous Hall effect in two-dimensional transition-metal dichalcogenides WTe2 and MoTe2

We studied the nonlinear electric response in WTe2 and MoTe2 monolayers. When the inversion symmetry is breaking but the the time-reversal symmetry is preserved, a second-order Hall effect called the nonlinear anomalous Hall effect (NLAHE) emerges owing to the nonzero Berry curvature on the nonequilibrium Fermi surface. We reveal a strong NLAHE with a Hall-voltage that is quadratic with respect to the longitudinal current. The optimal current direction is normal to the mirror plane in these two-dimensional (2D) materials. The NLAHE can be sensitively tuned by an out-of-plane electric field, which induces a transition from a topological insulator to a normal insulator. Crossing the critical transition point, the magnitude of the NLAHE increases, and its sign is reversed. Our work paves the way to discover exotic nonlinear phenomena in inversion-symmetry-breaking 2D materials.

cond-mat.mtrl-sci↗

Evolution of the magnetic excitations in NaOsO$_3$ through its metal-insulator transition

The temperature dependence of the excitation spectrum in NaOsO$_{\text{3}}$ through its metal-to-insulator transition (MIT) at 410 K has been investigated using resonant inelastic X-ray scattering (RIXS) at the Os L$_{\text{3}}$ edge. High resolution ($ΔE \sim$ 56 meV) measurements show that the well-defined, low energy magnons in the insulating state weaken and dampen upon approaching the metallic state. Concomitantly, a broad continuum of excitations develops which is well described by the magnetic fluctuations of a nearly antiferromagnetic Fermi liquid. By revealing the continuous evolution of the magnetic quasiparticle spectrum as it changes its character from itinerant to localized, our results provide unprecedented insight into the nature of the MIT in NaOsO$_{\text{3}}$.

cond-mat.str-el↗

Topological phase transition in a stretchable photonic crystal

We design a setup to realize tunable topological phases in elastic photonic crystals. Using the Su-Schrieffer-Heeger (SSH) model as a canonical example, we show how a system can be continuously tuned across its topological phase transition by stretching. We examine the setup both analytically and numerically, showing how the phase transition point may be identified from the behavior of bulk modes. Our design principle is generic as it can be applied to a variety of systems, and enables multiple new theoretical predictions to be experimentally tested by continuously strain-tuning system properties, such as the shape of the bandstructure and the topological invariant. In addition, it allows for cost-effective device fabrication, since a wide range of parameter space can be accessed on a single photonic crystal chip.

cond-mat.mes-hall↗

Symmetry regimes for circular photocurrents in monolayer MoSe2

In monolayer transition metal dichalcogenides helicity-dependent charge and spin photocurrents can emerge, even without applying any electrical bias, due to circular photogalvanic and photon drag effects. Exploiting such circular photocurrents (CPC) in devices, however, requires better understanding of their behavior and physical origin. Here, we present symmetry, spectral, and electrical characteristics of CPC from excitonic interband transitions in a MoSe2 monolayer. The dependence on bias and gate voltages reveals two different CPC contributions, dominant at different voltages and with different dependence on illumination wavelength and incidence angles. We theoretically analyze symmetry requirements for effects that can yield CPC and compare these with the observed angular dependence and symmetries that occur for our device geometry. This reveals that the observed CPC effects require a reduced device symmetry, and that effects due to Berry curvature of the electronic states do not give a significant contribution.

cond-mat.mtrl-sci↗

FeTaSb and FeMnTiSb as promising thermoelectric materials: An ab initio approach

Thermoelectricity in principle provides a pathway to put waste heat to good use. Motivated by this we investigate thermal and electrical transport properties of two new Fe-based Heusler alloys, FeTaSb and FeMnTiSb, by a first principles approach and semiclassical Boltzmann transport theory within the constant relaxation-time approximation. We find a high power factor of \textit{p}-doped FeTaSb, competitive with best performing Heusler alloy FeNbSb at 1100 K. The obtained power factor of \textit{n}-doped FeMnTiSb at room temperature is higher than that of both FeNbSb and FeTaSb. Remarkably, FeMnTiSb can be used for both \textit{n}-type and \textit{p}-type legs in a thermoelectric module. The Seebeck coefficients of the two proposed systems are in line with those of earlier reported Heusler alloys. We also provide conservative estimates of the figure of merit for the two systems. Overall, our findings suggest a high temperature thermoelectric potential of FeTaSb while the low cost FeMnTiSb is a viable room temperature thermoelectric candidate material.

cond-mat.mtrl-sci↗

Pressure-tuned magnetic interactions in honeycomb Kitaev materials

A range of honeycomb-lattice compounds has been proposed and investigated in the search for a topological Kitaev spin liquid. However, sizable Heisenberg interactions and additional symmetry-allowed exchange anisotropies in the magnetic Hamiltonian of these potential Kitaev materials push them away from the pure Kitaev spin-liquid state. Particularly the Kitaev-to-Heisenberg coupling ratio is essential in this respect. With the help of advanced quantum-chemistry methods, we explore how the magnetic coupling ratios depend on pressure in several honeycomb compounds (Na$_2$IrO$_3$, $β$-Li$_2$IrO$_3$, and $α$-RuCl$_3$). We find that the Heisenberg and Kitaev terms are affected differently by uniform pressure or strain: the Kitaev component increases more rapidly than the Heisenberg counterpart. This provides a scenario where applying pressure or strain can stabilize a spin liquid in such materials.

cond-mat.str-el↗

Ordered states in the Kitaev-Heisenberg model: From 1D chains to 2D honeycomb

We study the ground state of the 1D Kitaev-Heisenberg (KH) model using the density-matrix renormalization group and Lanczos exact diagonalization methods. We obtain a rich ground-state phase diagram as a function of the ratio between Heisenberg ($J=\cosϕ)$ and Kitaev ($K=\sinϕ$) interactions. Depending on the ratio, the system exhibits four long-range ordered states: ferromagnetic-$z$ , ferromagnetic-$xy$, staggered-$xy$, Néel-$z$, and two liquid states: Tomonaga-Luttinger liquid and spiral-$xy$. The two Kitaev points $ϕ=\fracπ{2}$ and $ϕ=\frac{3π}{2}$ are singular. The $ϕ$-dependent phase diagram is similar to that for the 2D honeycomb-lattice KH model. Remarkably, all the ordered states of the honeycomb-lattice KH model can be interpreted in terms of the coupled KH chains. We also discuss the magnetic structure of the K-intercalated RuCl$_3$, a potential Kitaev material, in the framework of the 1D KH model. Furthermore, we demonstrate that the low-lying excitations of the 1D KH Hamiltonian can be explained within the combination of the known six-vertex model and spin-wave theory.

cond-mat.str-el↗

Spin eigen-excitations of the magnetic skyrmion and problem of the effective mass

Properties of magnon modes localized on a ferromagnetic skyrmion are studied. Three types of possible asymptotic behavior of the modes eigenfrequencies are found for the case of large skyrmion radius $R_s$, namely $ω_0\sim R_s^{-2}$ for the breathing mode, $ω_{-|μ|}\sim R_s^{-1}$ and $ω_{|μ|}\sim R_s^{-3}$ for modes with negative and positive azimuthal quantum numbers, respectively. A number of properties of the magnon eigenfunctions are determined. This enables us to demonstrate that the skyrmion dynamics based on the traveling wave model is described by the massless Thiele equation.

cond-mat.str-el↗

Models and Materials for Generalized Kitaev Magnetism

The exactly solvable Kitaev model on the honeycomb lattice has recently received enormous attention linked to the hope of achieving novel spin-liquid states with fractionalized Majorana-like excitations. In this review, we analyze the mechanism proposed by G. Jackeli and G. Khaliullin to identify Kitaev materials based on spin-orbital dependent bond interactions and provide a comprehensive overview of its implications in real materials. We set the focus on experimental results and current theoretical understanding of planar honeycomb systems (Na$_2$IrO$_3$, $α$-Li$_2$IrO$_3$, and $α$-RuCl$_3$), three-dimensional Kitaev materials ($β$- and $γ$-Li$_2$IrO$_3$), and other potential candidates, completing the review with the list of open questions awaiting new insights.

cond-mat.str-el↗

The fate of interaction-driven topological insulators under disorder

We analyze the effect of disorder on the weak-coupling instabilities of quadratic band crossing point (QBCP) in two-dimensional Fermi systems, which, in the clean limit, display interaction- driven topological insulating phases. In the framework of a renormalization group procedure, which treats fermionic interactions and disorder on the same footing, we test all possible instabilities and identify the corresponding ordered phases in the presence of disorder for both single-valley and two-valley QBCP systems. We find that disorder generally suppresses the critical temperature at which the interaction-driven topologically non-trivial order sets in. Strong disorder can also cause a topological phase transition into a topologically trivial insulating state.

cond-mat.str-el↗

Hole-doped cobalt-based Heusler phases as prospective high-performance high-temperature thermoelectrics

Materials design based on first-principles electronic calculations has proven a fruitful strategy to identify new thermoelectric materials with a favorable figure of merit. Recent electronic structure calculations predict that in cobalt-based half-Heusler systems a power factor higher than in CoTiSb can be achieved upon p-type doping of CoVSn, CoNbSn, CoTaSn, CoMoIn, and CoWIn. Here, using a first-principles approach and semi-classical Boltzmann transport theory, we investigate the electrical and thermal transport properties of these materials. The calculated thermal conductivity at room temperature of all the systems is lower than that of CoTiSb, with CoMoIn and CoWIn having an almost 3-fold lower thermal conductivity than CoTiSb. We also provide conservative estimates of the figure of merit for these systems which all turn out to be higher than in CoTiSb and to have a maximum value for CoWIn.

cond-mat.mtrl-sci↗

Low temperature enhancement of ferromagnetic Kitaev correlations in α-RuCl3

Kitaev-type interactions between neighbouring magnetic moments emerge in the honeycomb material $α$-RuCl3. It is debated however whether these Kitaev interactions are ferromagnetic or antiferromagnetic. With electron energy loss spectroscopy (EELS) we study the lowest excitation across the Mott-Hubbard gap, which involves a d4 triplet in the final state and therefore is sensitive to nearest-neighbor spin-spin correlations. At low temperature the spectral weight of these triplets is strongly enhanced, in accordance with optical data. We show that the magnetic correlation function that determines this EELS spectral weight is directly related to a Kitaev-type spin-spin correlator and that the temperature dependence agrees very well with the results of a microscopic magnetic Hamiltonian for $α$-RuCl3 with ferromagnetic Kitaev coupling.

cond-mat.str-el↗