arXiv subjects

Andrey Prokofiev

Publications and source records attributed to Andrey Prokofiev.

13 recordsLinked to original sources

arXiv2026

Chiral Weyl-Kondo semimetals and hexagonal heavy fermion systems

Strong correlation, in concert with symmetry and topology, engenders novel gapless phases of matter, though only a tip of the iceberg has been seen. An exemplary framework is provided by Weyl-Kondo semimetals, in which Weyl fermions develop through crystalline symmetry constraints on the emergent low-energy heavy-fermion excitations. This paradigm has opened up new opportunities to explore correlated topologies without a noninteracting counterpart, but fully realizing this potential requires a large base of candidate materials. Here we confront the challenge on both fronts by studying heavy fermion systems with hexagonal space groups. This family contains a large number of chiral nonsymmorphic crystal structures that promote Weyl degeneracies and, in addition, feature geometric frustration in the $f$-electron magnetism. Our calculations for the heavy fermion states identify Weyl-Kondo semimetals with chiral or achiral Weyl nodes in the respective structural classes. We also develop the first search strategy of any kind for the difficult case of strongly correlated materials, which is also suitable for automation, using a combination of materials database, symmetry classification and search for desired experimental properties, and propose as candidate topological heavy fermion systems the chiral CePt$_2$B and achiral Ce$_2$NiGe$_3$ and Ce$_6$Co$_{2-δ}$Si$_3$. Our findings raise the prospect for strongly correlated metallic topology in the unusual setting of exotic quantum magnetism and, moreover, point a way to go beyond serendipity in the search for novel strongly correlated quantum materials.

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arXiv2025

Crystal field excitations in rattling clathrate CeBa$_7$Au$_6$Si$_{40}$

We investigate the local crystal-field environment of cerium in the clathrate compound CeBa$_7$Au$_6$Si$_{40}$ (Ce-BAS) using resonant inelastic x-ray scattering (RIXS) and magnetic susceptibility measurements. Ce-BAS is a rare example of a system where heavy-fermion physics coexists with low-energy rattling phonon modes, making it a candidate for enhanced thermoelectric performance. Magnetic susceptibility measurements reveal a temperature-dependent local moment that cannot be explained within a static crystal-field model. A fit to the susceptibility data requires strong mixing between the j = 5/2 and j = 7/2 crystal-field states, which implies large internal splittings inconsistent with RIXS spectra. In contrast, RIXS data are well described by a model with negligible j = 5/2 - j = 7/2 mixing and an energy separation of 12 meV between the ground and first excited crystal-field states. The inability to reconcile these two datasets within a static framework points to a dynamical modification of the crystal-field potential. We attribute this to coupling between the Ce 4f electrons and low-energy phonons associated with the Ce rattling motion. This interpretation is consistent with theoretical predictions of phonon-enhanced Kondo effects and dynamical Jahn-Teller distortions. Our results highlight the need for multi-orbital impurity models that include phonon coupling to fully describe the low-energy physics of Ce-BAS.

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arXiv2024

Magnetic Weyl-Kondo semimetals induced by quantum fluctuations

Weyl-Kondo semimetals are strongly correlated topological semimetals that develop through the cooperation of the Kondo effect with space group symmetries. The Kondo effect, capturing quantum fluctuations associated with strong correlations, is usually suppressed by magnetic order. Here we develop the theory of magnetic Weyl-Kondo semimetal. The key of the proposed mechanism is that the magnetic order comes from conduction $d$ electrons, such that the local $f$ moments can still fluctuate. We illustrate the extreme case where the magnetic space group symmetries prevent any spontaneous magnetization on the sites with the $f$-orbitals. In this case, topological degeneracies, including hourglass Weyl-Kondo nodal lines, appear when the magnetic space group symmetry constrains the Kondo-driven low-energy excitations; they lead to a third-order nonlinear anomalous Hall response. Based on the proposed mechanism, we explore the interplay between strong correlations and symmetries with database search leading to several candidate materials. The most prominent candidates are antiferromagnetic $\rm UNiGa$ and $\rm UNiAl$, with a third-order anomalous Hall response, as well as ferromagnetic $\rm USbTe$ and $\rm CeCoPO$, with a first-order one. Our findings pave the way for future experimental and theoretical investigations that promise to further advance the overarching theme of strongly correlated topology.

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arXiv2024

Quantum Fisher information in a strange metal

A strange metal is an exotic state of correlated quantum matter; intensive efforts are ongoing to decipher its nature. Here we explore whether the quantum Fisher information (QFI), a concept from quantum metrology, can provide new insight. We use inelastic neutron scattering and quantum Monte Carlo simulations to study a Kondo destruction quantum critical point, where strange metallicity is associated with fluctuations beyond a Landau order parameter. We find that the QFI probed away from magnetic Bragg peaks, where the effect of magnetic ordering is minimized, increases strongly and without a characteristic scale as the strange metal forms with decreasing temperature, evidencing its unusual entanglement properties. Our work opens a new direction for studies across strange metal platforms.

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arXiv2023

Size effect on the thermal conductivity of a type-I clathrate

Clathrates are a materials class with an extremely low phonon thermal conductivity, which is a key ingredient for a high thermoelectric conversion efficiency. Here, we present a study on the type-I clathrate La$_{1.2}$Ba$_{6.8}$Au$_{5.8}$Si$_{38.8}\square_{1.4}$ directed at lowering the phonon thermal conductivity even further by forming mesoscopic wires out of it. Our hypothesis is that the interaction of the low-energy rattling modes of the guest atoms (La and Ba) with the acoustic modes, which originate mainly from the type-I clathrate framework (formed by Au and Si atoms, with some vacancies $\square$), cuts off their dispersion and thereby tilts the balance of phonons relevant for thermal transport to long-wavelength ones. Thus, size effects are expected to set in at relatively long length scales. The structuring was carried out using a top-down approach, where the wires, ranging from 1260 nm to 630 nm in diameter, were cut from a piece of single crystal using a focused ion beam technique. Measurements of the thermal conductivity were performed with a self-heating $3ω$ technique down to 80 K. Indeed, they reveal a reduction of the room-temperature phonon thermal conductivity by a sizable fraction of $\sim$40 % for our thinnest wire, thereby confirming our hypothesis.

cond-mat.mtrl-sci↗

arXiv2022

Topological semimetals without quasiparticles

The interplay between interactions and topology in quantum materials is of extensive current interest. Strong correlations are known to be important for insulating topological states, as exemplified by the fractional quantum Hall effect. For the metallic case, whether and how they can drive topological states that have no free-electron counterparts is an open and pressing question. We introduce a general framework for lattice symmetries to constrain single-particle excitations even when they are not quasiparticles, and substantiate it in a periodic Anderson model with two channels of conduction electrons. We demonstrate that symmetry constrains correlation-induced emergent excitations to produce non-Fermi liquid topological phases. The loss of quasiparticles in these phases is manifested in a non-Fermi liquid form of spectral and transport properties, whereas its topological nature is characterized by surface states and valley and spin Hall conductivities. We also identify candidate materials to realize the proposed phases. Our work opens a door to a variety of non-Fermi liquid topological phases in a broad range of strongly correlated materials.

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arXiv2022

Topological Semimetal driven by Strong Correlations and Crystalline Symmetry

Electron correlations amplify quantum fluctuations and, as such, they have been recognized as the origin of a rich landscape of quantum phases. Whether and how they lead to gapless topological states is an outstanding question, and a framework that allows for determining novel phases and identifying new materials is in pressing need. Here we advance a general approach, in which strong correlations cooperate with crystalline symmetry to drive gapless topological states. We test this materials design principle by exploring Kondo lattice models and materials whose space group symmetries may promote different kinds of electronic degeneracies, with a particular focus on square-net systems. Weyl-Kondo nodal-line semimetals -- with nodes pinned to the Fermi energy -- are identified. We describe how this approach can be applied to discover strongly correlated topological semimetals, identify three heavy fermion compounds as new candidates, provide first direct experimental evidence for our prediction in Ce$_2$Au$_3$In$_5$, and discuss how our approach may lead to many more. Our findings illustrate the potential of the proposed materials design principle to guide the search for new topological metals in a broad range of strongly correlated systems.

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arXiv2021

Controlling electronic topology in a strongly correlated electron system

Combining strong electron correlations [1-4] and nontrivial electronic topology [5] holds great promise for discovery. So far, this regime has been rarely accessed and systematic studies are much needed to advance the field. Here we demonstrate the control of topology in a heavy fermion system. We use magnetic field to manipulate Weyl nodes in a Weyl-Kondo semimetal [6-8], up to the point where they annihilate in a topological quantum phase transition. The suppression of the topological characteristics occurs in an intact and only weakly varying strongly correlated "background". Thus, topology is changing per se and not as a consequence of a change of the correlation state, for instance across a magnetic, electronic or structural phase transition. Our demonstration of genuine topology tuning in a strongly correlated electron system sets the stage for establishing global phase diagrams of topology, an approach that has proven highly valuable to explore and understand topologically trivial strongly correlated electron systems [1-4]. Our work also lays the ground for technological exploitations of controlled electronic topology.

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arXiv2021

Giant spontaneous Hall effect in a nonmagnetic Weyl-Kondo semimetal

Nontrivial topology in condensed matter systems enriches quantum states of matter, to go beyond either the classification into metals and insulators in terms of conventional band theory or that of symmetry broken phases by Landau's order parameter framework. So far, focus has been on weakly interacting systems, and little is known about the limit of strong electron correlations. Heavy fermion systems are a highly versatile platform to explore this regime. Here we report the discovery of a giant spontaneous Hall effect in the Kondo semimetal Ce3Bi4Pd3 that is noncentrosymmetric but preserves time reversal symmetry. We attribute this finding to Weyl nodes - singularities of the Berry curvature - that emerge in the immediate vicinity of the Fermi level due to the Kondo interaction. We stress that this phenomenon is distinct from the previously detected anomalous Hall effect in materials with broken time reversal symmetry; instead, it manifests an extreme topological response that requires a beyond-perturbation-theory description of the previously proposed nonlinear Hall effect. The large magnitude of the effect in even tiny electric and zero magnetic fields, as well as its robust bulk nature may aid the exploitation in topological quantum devices.

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arXiv2020

$^{105}$Pd NMR and NQR study of the cubic heavy fermion system Ce$_3$Pd$_{20}$Si$_6$

We report $^{105}$Pd NMR and NQR measurements on a single crystal of Ce$_3$Pd$_{20}$Si$_6$, where antiferroquadrupolar and antiferromagnetic orders develop at low temperature. From the analysis of NQR and NMR spectra, we have determined the electric field gradient (EFG) tensors and the anisotropic Knight shift ($K$) components for both inequivalent Pd sites - Pd($32f$) and Pd($48h$). The observed EFG values are in excellent agreement with our state-of-the-art DFT calculations. The principal values of the quadrupolar coupling are $(20.37 \pm 0.02)$ MHz and $(5.45 \pm 0.02)$ MHz, for the Pd($32f$) and Pd($48h$) site, respectively, which is large compared to the Larmor frequency defined by the gyromagnetic constant $γ= 1.94838$ MHz/T for $^{105}$Pd. Therefore, the complete knowledge of $K$ and the EFG tensors is crucial to establish the correspondence between NMR spectra and crystallographic sites, which is needed for a complete analysis of the magnetic structure, static spin susceptibility, and the spin-lattice relaxation rate data and a better understanding of the groundstate of Ce$_3$Pd$_{20}$Si$_6$.

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arXiv2018

Chirality-driven ferroelectricity in LiCuVO$_4$

Chirality or the handedness of objects is of prime importance in life science, biology, chemistry and physics. It is also a major symmetry ingredient in frustrated magnets revealing spin-spiral ground states. Vector chiral phases, with the twist (either clock- or counter clock-wise) between neighbouring spins being ordered, but with disorder with respect to the angles between adjacent spins, have been predicted almost five decades ago. Experimental proofs, however, are rare and controversial. Here, we provide experimental evidence for such a phase in LiCuVO$_4$, a one-dimensional quantum magnet with competing ferromagnetic and antiferromagnetic interactions. The vector chiral state is identified via a finite ferroelectric polarization arising at temperatures well above the multiferroic phase exhibiting long-range three-dimensional spin-spiral and polar order. On increasing temperatures, spin order becomes suppressed at TN, while chiral long-range order still exist, leaving a temperature window with chirality-driven ferroelectricity in the presence of an external magnetic field.

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arXiv2018

Determining the local low-energy excitations in the Kondo semimetal CeRu$_4$Sn$_6$ using resonant inelastic x-ray scattering

We have investigated the local low-energy excitations in CeRu$_4$Sn$_6$, a material discussed recently in the framework of strongly correlated Weyl semimetals, by means of Ce $M_5$ resonant inelastic x-ray scattering (RIXS). The availability of both $^2$F$_\frac{5}{2}$ and $^2$F$_\frac{7}{2}$ excitations of the Ce $4f^1$ configuration in the spectra allows for the determination of the crystal-electric field parameters that explain quantitatively the temperature dependence and anisotropy of the magnetic susceptibility. The absence of an azimuthal dependence in the spectra indicates that all crystal-electric field states are close to being rotational symmetric. We show further that the non-negligible impact of the $\check A_6^0$ parameter on the ground state of CeRu$_4$Sn$_6$ leads to a reduction of the magnetic moment due to multiplet intermixing. The RIXS results are consistent with inelastic neutron scattering (INS) data and are compared to the predictions from \textsl{ab-initio} based electronic structure calculations.

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arXiv2017

Suppression of vacancies boosts thermoelectric performance in type-I clathrates

Intermetallic type-I clathrates continue to attract attention as promising thermoelectric materials. Here we present structural and thermoelectric properties of single crystalline Ba8(Cu,Ga,Ge,v)46, where v denotes a vacancy. By single crystal X-ray diffraction on crystals without Ga we find clear evidence for the presence of vacancies at the 6c site in the structure. With increasing Ga content, vacancies are successively filled. This increases the charge carrier mobility strongly, even within a small range of Ga substitution, leading to reduced electrical resistivity and enhanced thermoelectric performance. The largest figure of merit ZT =0.9 at 900 K is found for a single crystal of approximate composition Ba8Cu4.6Ga1.0Ge40.4. This value, that may further increase at higher temperatures, is one of the largest to date found in transition metal element-based clathrates.

cond-mat.mtrl-sci↗