arXiv subjects

Ulrich Burkhardt

Publications and source records attributed to Ulrich Burkhardt.

13 recordsLinked to original sources

arXiv2026

Unveiling orbital landscapes in strongly correlated bulk nickelates with $s$-NIXS

We leverage $s$-orbital non-resonant inelastic X-ray scattering ($s$-NIXS) to perform orbital imaging on three bulk rare-earth nickelates spanning a range of formal nickel valence (3$d$ electron filling) from Ni$^{3+}$ (3$d^7$) to Ni$^{1+}$ (3$d^9$). Our results directly reveal the ground states of these compounds all with minimal theoretical input. In particular, we demonstrate the low-spin orbital configuration of trivalent LaNiO$_3$, the $d_{x^2-y^2}$ configuration of monovalent LaNiO$_2$, and resolve the effective $e_g$ crystal field splitting in the distorted octahedral environment of divalent La$_2$NiO$_4$. This work illustrates the potential of $s$-NIXS to study the ground state and excited states of strongly correlated materials without needing complex theoretical analysis of spectroscopic data.

cond-mat.str-el↗

arXiv2026

Anisotropic anomalous Hall effect in distorted kagome GdTi3Bi4

Topological kagome magnets offer a rich landscape for exploring the intricate interplay of quantum interactions among geometry, topology, spin, and correlation. GdTi3Bi4 crystallizes in layered Ti based kagome nets intertwined with zigzag Gd chains along the a axis and orders antiferromagnetically below 15 K. Here, we present the temperature and field dependent electrical transport of GdTi3Bi4 in different directions. The material exhibits anomalous Hall conductivity (AHC) of 410 S cm-1 at 2 K for B parallel c and it is completely absent for B parallel a, despite the similar magnetization observed in both orientations. This behavior is quite contradictory, as anomalous Hall effect (AHE) typically scales with the magnetization. Through first principles calculations, it is demonstrated that in the presence of time reversal symmetry broken by the Gd 4f sublattice and spin orbit coupling, the magnetization direction controls the orbital mixing in the Ti t2g bands, relocating Berry curvature hot spots and producing the observed orientation selective AHC. The results establish GdTi3Bi4 as platform for investigating new avenues of AHE, such as directional AHE, and thus shed new light on the intricate coupling between magnetic and electronic structures, paving the way for exploring novel quantum phenomena.

cond-mat.mtrl-sci↗

arXiv2025

Low-field magnetization processes of hexagonal easy-plane altermagnet $\alpha$-MnTe

Single crystals of $\alpha$-MnTe were synthesized by chemical vapor transport using iodine as the transport reagent. Structural characterization by powder x-ray diffraction confirmed the hexagonal structure (space group P6$_{3}$/mmc). Magnetization $M(T)$ and specific heat $C_p(T)$ measurements revealed an antiferromagnetic phase transition at $T_N \approx307$ K. The magnetic entropy derived from the $C_p(T)$ data is consistent with the $S = 5/2$ spin state of Mn$^{2+}$ ions. Angle- and field-dependent magnetization measurements indicate complex magnetic responses associated with domains, and show an anomaly around 1 T. These features are analyzed using a phenomenological micromagnetic model that includes higher-order anisotropic exchange interactions coupling the weak ferromagnetic component and the antiferromagnetic order parameter. The model captures the generic behavior of magnetic states and demonstrates that the observed uniaxial and unidirectional anisotropies arise from metastable domain configurations and irreversible magnetization processes.

cond-mat.mtrl-sci↗

arXiv2025

Anisotropy of the chiral, semiconducting phase LaRhC$_{2}$: a handedness resolved study

Chirality in quantum materials is a topic of significant importance due to its profound effects on the electronic, magnetic, and optical properties of these systems. However, it is non-trivial to decouple the behavior of two enantiomorphs within the same material -- perhaps explaining why the influence of chirality on electrical properties has remained largely unexplored. In this work, we examine the electrical conductivity, magnetoresistance, and thermal expansion coefficient of LaRhC$_{2}$ -- a compound with a chiral crystal structure (tetragonal symmetry, space groups $\textit{P}$4$_{1}$ or $\textit{P}$4$_{3}$). The identification of a suitable monochiral domain was achieved via electron backscatter diffraction, which simultaneously determines crystallographic orientation and handedness. Both enantiomorphs are confirmed by single-crystal X-ray diffraction on monochiral specimens. The analysis of electrical resistivity was made possible through the single-domain extraction of enantiopure specimens from a polycrystalline sample using focused ion beam techniques. We establish that LaRhC$_{2}$ is a semiconductor with band gaps of approximately 20 meV and 33 meV parallel and perpendicular to the fourfold screw axis of the crystal structure, respectively -- consistent with band structure calculations. A significant anisotropy is also observed in the thermal expansion, electrical resistivity as well as angular-dependent magnetoresistance parallel and perpendicular o [001] crystallographic directions.

cond-mat.mtrl-sci↗

arXiv2025

Unusual magnetic order in Eu$_{10}$Hg$_{55}$

In solid-state compounds, the valence of europium can sometimes be mixed -- which is especially favored in structures with several positions for the europium atoms. In this work, we study the Eu-based intermetallic noncentrosymmetric system Eu$_{10}$Hg$_{55}$ which has 65 atoms per unit cell and 4 distinct crystallographic positions for europium and 17 positions for mercury. Our detailed analysis of magnetism of large single crystals suggests that europium in Eu$_{10}$Hg$_{55}$ might be present in two valence states, resulting in a fragile magnetic ground state. Due to the cage-like structure with a large distance between the Eu atoms, those atoms are weakly ferromagnetically coupled and Eu$_{10}$Hg$_{55}$ orders at low temperatures, below $T_{1} = 5.5$ K, with a subsequent spin re-orientation at $T_{2} = 4.3$ K. There is no sign of magnetic frustration. Interestingly, the magnetic ordering of europium sub-lattices results in a magnetization pole reversal with a weak ferrimagnetic ground state. Additional magnetic phases can be induced by application of a modest external magnetic field.

cond-mat.mtrl-sci↗

arXiv2024

Striped magnetization plateau and chirality-reversible anomalous Hall effect in a magnetic kagome metal

Kagome materials with magnetic frustration in two-dimensional networks are known for their exotic properties, such as the anomalous Hall effect (AHE) with non-collinear spin textures. However, the effects of one-dimensional (1D) spin chains within these networks are less understood. Here, we report a distinctive AHE in the bilayer-distorted kagome material GdTi$_3$Bi$_4$, featuring 1D Gd zigzag spin chains, a one-third magnetization plateau, and two successive metamagnetic transitions. At these metamagnetic transitions, Hall resistivity shows abrupt jumps linked to the formation of stripe domain walls, while within the plateau, the absence of detectable domain walls suggests possible presence of skyrmion phase. Reducing the sample size to a few microns reveals additional Hall resistivity spikes, indicating domain wall skew scattering contributions. Magnetic atomistic spin dynamics simulations reveal that the magnetic textures at these transitions have reverse chirality, explaining the evolution of AHE and domain walls with fields. These results underscore the potential of magnetic and crystal symmetry interplay, and magnetic field-engineered spin chirality, for controlling domain walls and tuning transverse properties, advancing spintronic applications.

cond-mat.str-el↗

arXiv2021

Fixing Left and Right: Assignment of Chiral Elemental Crystal Structures using Kikuchi Diffraction

Crystals of the chemical elements manganese, tellurium, and selenium can show the effects of handedness. In order to sense the possible effects of a changing sense of chirality on the properties of samples from these elements, the potential presence of two, enantiomorphic, physically different, variants of these elemental crystal structures needs to be resolved in crystallographic analyses. Due to fundamental limitations of kinematical X-ray scattering in crystals, however, the effects of chirality in single-element crystals are very difficult to sense using standard X-ray diffraction techniques. In the present paper, we show that dynamical Kikuchi diffraction in the scanning electron microscope is sensitive to the local sense of chirality in crystals of single chemical elements. We demonstrate chirality assignment in $β$-manganese, and we determine the sense of crystal chirality from Kikuchi diffraction patterns of the trigonal structures of tellurium and selenium.

cond-mat.mtrl-sci↗

arXiv2017

Coexistence of magnetic order and valence fluctuations in the Kondo lattice system Ce$_2$Rh$_3$Sn$_5$

We report on the electronic band structure, structural, magnetic and thermal properties of Ce$_2$Rh$_3$Sn$_5$. Ce $L_{\mathrm{III}}$-edge XAS spectra give direct evidence for an intermediate valence behaviour. Thermodynamic measurements reveal magnetic transitions at $T_{\mathrm{N1}}\approx$ 2.9 K and $T_{\mathrm{N2}}\approx$ 2.4 K. Electrical resistivity shows behaviour typical for Kondo lattices. The coexistence of magnetic order and valence fluctuations in a Kondo lattice system we attribute to a peculiar crystal structure in which Ce ions occupy two distinct lattice sites. Analysis of the structural features of Ce$_2$Rh$_3$Sn$_5$, together with results of electronic band structure calculations and thermodynamic data indicate that Ce2 ions are in an intermediate valence state with the ground state electronic configuration close to 4$f^0$, whereas Ce1 ions are trivalent (4$f^1$) and contribute to the low temperature magnetic ordering. Thus, our joined experimental and theoretical investigations classify Ce$_2$Rh$_3$Sn$_5$ as a multivalent charge-ordered system.

cond-mat.str-el↗

arXiv2016

Quantum phase transitions and multicriticality in Ta(Fe1-xVx)2

We present a comprehensive study of synthesis, structure analysis, transport and thermodynamic properties of the C14 Laves phase Ta(Fe1-xVx)2. Our measurements confirm the appearance of spin-density wave (SDW) order within a dome-like region of the x - T phase diagram with vanadium content 0.02 < x < 0.3. Our results indicate that on approaching TaFe2 from the vanadium-rich side, ferromagnetic (FM) correlations increase faster than the antiferromagnetic (AFM) ones. This results in an exchange-enhanced susceptibility and in the suppression of the SDW transition temperature for x < 0.13 forming the dome-like shape of the phase diagram. This effect is strictly related to a significant lattice distortion of the crystal structure manifested in the c/a ratio. At x = 0.02 both FM and AFM energy scales have similar strength and the system remains paramagnetic down to 2 K with an extremely large Stoner enhancement factor of about 400. Here, spin fluctuations dominate the temperature dependence of the resistivity ρ~ T ^ 3/2 and of the specific heat C/T ~ - log(T) which deviate from their conventional Fermi liquid forms, inferring the presence of a quantum critical point of dual nature.

cond-mat.str-el↗

arXiv2016

Ternary borides Nb$_7$Fe$_3$B$_8$ and Ta$_7$Fe$_3$B$_8$ with Kagome-type iron framework

Two new ternary borides $TM$$_7$Fe$_3$B$_8$ ($TM$ = Nb, Ta) were synthesized by high-temperature thermal treatment of samples obtained by arc-melting. This new type of structure with space group $P$6/$mmm$, comprises $TM$ slabs containing isolated planar hexagonal [B$_6$] rings and iron centered $TM$ columns in a Kagome type of arrangement. Chemical bonding analysis in Nb$_7$Fe$_3$B$_8$ by means of the electron localizability approach reveals two-center interactions forming the Kagome net of Fe and embedded B, while weaker multicenter bonding present between this net and Nb atoms. Magnetic susceptibility measurements reveal antiferromagnetic order below $T_N$ = 240 K for Nb$_7$Fe$_3$B$_8$ and $T_N$ =265 K for Ta$_7$Fe$_3$B$_8$. Small remnant magnetization below 0.01 $μ_B$/f.u. is observed in the antiferromagnetic state. The bulk nature of the magnetic transitions was confirmed by the hyperfine splitting of the Mößbauer spectra, the sizable anomalies in the specific heat capacity, and the kinks in the resistivity curves. The high-field paramagnetic susceptibilities fitted by the Curie-Weiss law show effective paramagnetic moments $μ_{eff}$ about 3.1 $μ_B$/Fe in both compounds. The temperature dependence of the electrical resistivity also reveals metallic character of both compounds. Density functional calculations corroborate the metallic behaviour of both compounds and demonstrate the formation of a sizable local magnetic moment on the Fe-sites. They indicate the presence of both antiferro- and ferromagnetic interactions.

cond-mat.mtrl-sci↗

arXiv2015

Synthesis and Crystal Growth of Tetragonal Fe1.00Se

Single crystals of tetragonal Fe1.00Se were grown from polycrystalline material by chemical vapor transport reaction at temperatures below 723 K using AlCl3 as transport additive. The plate-shaped single crystals have edge lengths up to 4 mm. The single crystals display complete diamagnetic shielding factor 4piX = -1 below the superconducting transition.

cond-mat.supr-con↗

arXiv2015

High thermoelectric figure of merit in p-type Half-Heuslers by intrinsic phase separation

Improvements in the thermoelectric properties of Half-Heusler materials have been achieved by means of a micrometer-scale phase separation that increases the phonon scattering and reduces the lattice thermal conductivity. A detailed study of the p-type Half-Heusler compounds Ti(1-x)Hf(x)CoSb0.85Sn0.15 using high-resolution synchrotron powder X-ray diffraction and element mapping electron microscopy evidences the outstanding thermoelectric properties of this system. A combination of intrinsic phase separation and adjustment of the carrier concentration via Sn substitution is used to realize a record thermoelectric figure of merit for p-type Half-Heusler compounds of ZT around 1.15 at 710C in Ti0.25Hf0.75CoSb0.85Sn0.15. The phase separation approach can form a significant alternative to nanostructuring processing time, energy consumption and increasing the thermoelectric efficiency.

cond-mat.mtrl-sci↗

arXiv2009

AFe2As2 (A = Ca, Sr, Ba, Eu) and SrFe_(2-x)TM_(x)As2 (TM = Mn, Co, Ni): crystal structure, charge doping, magnetism and superconductivity

The electronic structure and physical properties of the pnictide compound families $RE$OFeAs ($RE$ = La, Ce, Pr, Nd, Sm), $A$Fe$_{2}$As$_{2}$ ($A$ = Ca, Sr, Ba, Eu), LiFeAs and FeSe are quite similar. Here, we focus on the members of the $A$Fe$_{2}$As$_{2}$ family whose sample composition, quality and single crystal growth are better controllable compared to the other systems. Using first principles band structure calculations we focus on understanding the relationship between the crystal structure, charge doping and magnetism in $A$Fe$_{2}$As$_{2}$ systems. We will elaborate on the tetragonal to orthorhombic structural distortion along with the associated magnetic order and anisotropy, influence of doping on the $A$ site as well as on the Fe site, and the changes in the electronic structure as a function of pressure. Experimentally, we investigate the substitution of Fe in SrFe$_{2-x}TM_{x}$As$_{2}$ by other 3$d$ transition metals, $TM$ = Mn, Co, Ni. In contrast to a partial substitution of Fe by Co or Ni (electron doping) a corresponding Mn partial substitution does not lead to the supression of the antiferromagnetic order or the appearance of superconductivity. Most calculated properties agree well with the measured properties, but several of them are sensitive to the As $z$ position. For a microscopic understanding of the electronic structure of this new family of superconductors this structural feature related to the Fe-As interplay is crucial, but its correct ab initio treatment still remains an open question.

cond-mat.supr-con↗