arXiv subjects

M. Rotter

Publications and source records attributed to M. Rotter.

At least 19 recordsLinked to original sources

arXiv2025

Magnetic anisotropy and dipolar interactions in the frustrated triangular-lattice magnet NaGdS_2

In this comprehensive study, we present results of bulk measurements (magnetization, specific heat, ac susceptibility, thermal expansion, and magnetostriction) combined with local methods such as nuclear magnetic resonance (^23Na NMR) and electron spin resonance (ESR) and simulations (McPhase) on polycrystalline and single-crystalline NaGdS_2 samples. The rare-earth delafossite NaGdS_2 is a triangular-lattice magnet with S = 7/2 spin-only Gd^3+ moments with suppressed single-ion anisotropy. In our study, we estimate that NaGdS_2 has a weak antiferromagnetic exchange (J_H/k_B is about 52mK) and signs of long-range magnetic order are absent down to lowest temperature. However, indications of short range magnetic order are found below 180 mK in the ac susceptibility and thermal expansion. Our results indicate an interplay of Heisenberg-type and dipolar exchange. Due to the large moment of the Gd^3+ ions, one expects a strong impact of the dipolar coupling in NaGdS_2, in contrast to the related NaYbS_2. ESR and ^23Na NMR measurements, indeed, indicate the formation of short-range ferromagnetic correlations. NaGdS_2 appears to be a rare system, in which magnetic order is suppressed by a competition between Heisenberg and dipolar interactions.

cond-mat.str-el↗

arXiv2025

Contrasting magnetic behavior in MnSc_2X_4 (X = S, Se) spinel compounds investigated by magnetoelastic studies

The spinel compounds MnSc_2X_4 are highly frustrated and candidate materials for vortex-like 3q magnetic states, such as skyrmions, with propagation vectors in the [111] plane. Because of the strong magnetoelastic coupling, we could extract a refined magnetic (H, T) phase diagram for MnSc_2S_4 from ultrasound and dilatometry measurements. We found a variety of magnetic phases, including the skyrmion phase, which is stable down to lowest temperatures. In comparison, we investigated MnSc_2Se_4 , having a larger distance between the magnetic Mn^3+ ions using the same methods. Unlike in MnSc_2S_4 , we found no skyrmion phase and overall a lack of sharp anomalies indicative of phase transitions, neither in dilatometry nor ultrasound nor in specific heat and ac-susceptibility data. Motivated by our findings, we performed model calculations, which reproduced the experimentally observed magnetostriction and specific-heat results reasonably well.

cond-mat.str-el↗

arXiv2025

Quantum spin liquid ground state in a rare-earth triangular antiferromagnet SmTa$_7$O$_{19}$

The rare-earth-based geometrically frustrated triangular magnets have attracted considerable attention due to the intricate interplay between strong spin-orbit coupling and the crystal electric field (CEF), which often leads to effective spin-1/2 degrees of freedom and therefore promotes strong quantum fluctuations at low temperatures, thus offering an excellent route to stabilize a quantum spin liquid (QSL) ground state. We have investigated the ground state magnetic properties of a polycrystalline sample of $\text{SmTa}_7\text{O}_{19}$ which we propose to have a gapless QSL ground state by employing powder X-ray diffraction (XRD), X-ray absorption spectroscopy (XAS), DC and AC-magnetic susceptibility, $M$ vs. $H$ isotherm, specific heat, and muon spin rotation/relaxation measurements ($\mu$SR) down to 30 mK. The combined structural and electronic studies reveal the formation of an edge-sharing equilateral triangular lattice of Sm$^{3+}$ ions in $ab$ plane. The DC, AC magnetic susceptibility, and heat capacity measurements reveal that $\text{SmTa}_7\text{O}_{19}$ does not exhibit any long-range magnetic ordering transition down to 50 mK. The zero-field (ZF)-$\mu$SR study strongly refutes the long-range magnetically ordered ground state and/or any partial spin-freezing down to at least 30 mK. The ZF-muon-spin relaxation rate is weakly temperature dependent between 50 and 20 K, rapidly increases below $\sim$20 K and saturates at low temperatures between 2 K and 30 mK, which has been attributed to a characteristic signature of QSL systems. Further, our longitudinal-field (LF)-$\mu$SR measurements at 0.1 K reveal a dynamic nature of the magnetic ground state. In addition, our high-field specific heat data suggest a gapless nature of spin excitations in this compound.

cond-mat.str-el↗

arXiv2023

Role of crystal field ground state in the classical spin-liquid behavior of a quasi-one dimensional spin-chain system Sr3NiPtO6

The spin-chain compound Sr3NiPtO6 is known to have a nonmagnetic ground state. We have investigated the nature of ground state of Sr3NiPtO6 using magnetic susceptibility $\chi(T)$, heat capacity $C_{\rm p}(T)$, muon spin relaxation ($\mu$SR) and inelastic neutron scattering (INS) measurements. The $\chi(T)$ and $C_{\rm p}(T)$ do not exhibit any pronounced anomaly that can be associated with a phase transition to a magnetically ordered state. Our $\mu$SR data confirm the absence of long-range magnetic ordering down to 0.04 K. Furthermore, the muon spin relaxation rate increases below 20 K and exhibits temperature independent behavior at low temperature, very similar to that observed in a quantum spin-liquid system. The INS data show a large excitation near 8~meV, and the analysis of the INS data reveals a singlet CEF ground state with a first excited CEF doublet state at $\Delta_{\rm CEF}$ = 7.7 meV. The estimated CEF parameters reveal a strong planar anisotropy in the calculated $\chi(T)$, consistent with the reported behavior of the $\chi(T)$ of single crystal Sr3NiPtO6. We propose that the nonmagnetic singlet ground state and a large $\Delta_{\rm CEF}$ (much larger than the exchange interaction $\mathcal{J}_{\rm ex}$) are responsible for the absence of long-range magnetic ordering and can mimic a classical spin-liquid behavior in this quasi-1D spin chain system Sr3NiPtO6. The classical spin-liquid ground state observed in Sr3NiPtO6 is due to the single-ion property, which is different from the quantum spin-liquid ground state observed in geometrically frustrated systems, where two-ion exchanges play an important role.

cond-mat.str-el↗

arXiv2020

Extremely slow non-equilibrium monopole dynamics in classical spin ice

We report on the non-equilibrium monopole dynamics in the classical spin ice Dy$_2$Ti$_2$O$_7$ detected by means of high-resolution magnetostriction measurements. Significant lattice changes occur at the transition from the kagome-ice to the saturated-ice phase, visible in the longitudinal and transverse magnetostriction. A hysteresis opening at temperatures below 0.6 K suggests a first-order transition between the kagome and saturated state. Extremely slow lattice relaxations, triggered by changes of the magnetic field, were observed. These lattice-relaxation effects result from non-equilibrium monopole formation or annihilation processes. The relaxation times extracted from our experiment are in good agreement with theoretical predictions with decay constants of the order of $10{^4}$ s at 0.3 K.

cond-mat.str-el↗

arXiv2016

Electronic and magnetic nano phase separation in cobaltates La$_{2-x}$Sr$_{x}$CoO$_4$

The single-layer perovskite cobaltates have attracted enormous attention due to the recent observation of hour-glass shaped magnetic excitation spectra which resemble the ones of the famous high-temperature superconducting cuprates. Here, we present an overview of our most recent studies of the spin and charge correlations in floating-zone grown cobaltate single crystals. We find that frustration and a novel kind of electronic and magnetic nano phase separation are intimately connected to the appearance of the hour-glass shaped spin excitation spectra. We also point out the difference between nano phase separation and conventional phase separation.

cond-mat.str-el↗

arXiv2015

Hour-glass magnetic excitations induced by nanoscopic phase separation in cobalt oxides La$_{2-x}$Sr$_x$CoO$_4$

The magnetic excitations in the cuprate superconductors might be essential for an understanding of high-temperature superconductivity. In these cuprate superconductors the magnetic excitation spectrum resembles an hour-glass and certain resonant magnetic excitations within are believed to be connected to the pairing mechanism which is corroborated by the observation of a universal linear scaling of superconducting gap and magnetic resonance energy. So far, charge stripes are widely believed to be involved in the physics of hour-glass spectra. Here we study an isostructural cobaltate that also exhibits an hour-glass magnetic spectrum. Instead of the expected charge stripe order we observe nano phase separation and unravel a microscopically split origin of hour-glass spectra on the nano scale pointing to a connection between the magnetic resonance peak and the spin gap originating in islands of the antiferromagnetic parent insulator. Our findings open new ways to theories of magnetic excitations and superconductivity in cuprate superconductors.

cond-mat.str-el↗

arXiv2014

Mechanism of spin crossover in LaCoO3 resolved by shape magnetostriction in pulsed magnetic fields

In the scientific description of unconventional transport properties of oxides (spin-dependent transport, superconductivity etc.), the spin-state degree of freedom plays a fundamental role. Because of this, temperature- or magnetic field-induced spin-state transitions are in the focus of solid-state physics. Cobaltites, e.g. LaCoO3, are prominent examples showing these spin transitions. However, the microscopic nature of the spontaneous spin crossover in LaCoO3 is still controversial. Here we report magnetostriction measurements on LaCoO3 in magnetic fields up to 70 T to study the sharp, field-induced transition at Hc ~ 60 T. Measurements of both longitudinal and transversal magnetostriction allow us to separate magnetovolume and magnetodistortive changes. We find a large increase in volume, but only a very small increase in tetragonal distortion at Hc. The results, supported by electronic energy calculations by the configuration interaction cluster method, provide compelling evidence that above Hc LaCoO3 adopts a correlated low spin/high spin state.

cond-mat.mtrl-sci↗

arXiv2013

Spectroscopic evidence for giant orbital moment and magnetic anisotropy induced by local distortions in alpha-CoV2O6

We present a combined experimental and theoretical study on the local magnetism of the Co ions in the spin-chain compound CoV2O6, which crystallizes in two different allotropic phases, alpha- and gamma-CoV2O6. Using x-ray magnetic circular dichroism, we have found a very large and a moderate orbital contribution to the magnetism in alpha- and gamma-CoV2O6, respectively. Full-multiplet calculations indicate that the differences in the magnetic behavior of alpha- and gamma-CoV2O6 phases originate from different local distortions of the CoO6 octahedra. In particular, the strong compression of the CoO6 octahedra in alpha-CoV2O6 lead to a strong mixture of t2g and eg orbitals which, via the local atomic Coulomb and exchange interactions, results in an exceptionally large orbital moment.

cond-mat.str-el↗

arXiv2013

Magnetic ordering in GdNi2B2C revisited by resonant x-ray scattering: evidence for the double-q model

Recent theoretical efforts aimed at understanding the nature of antiferromagnetic ordering in GdNi2B2C predicted double-q ordering. Here we employ resonant elastic x-ray scattering to test this theory against the formerly proposed, single-q ordering scenario. Our study reveals a satellite reflection associated with a mixed-order component propagation wave vector, viz., (q_a,2q_b,0) with q_b = q_a approx= 0.55 reciprocal lattice units, the presence of which is incompatible with single-q ordering but is expected from the double-q model. A (3q_a,0,0) wave vector (i.e., third-order) satellite is also observed, again in line with the double-q model. The temperature dependencies of these along with that of a first-order satellite are compared with calculations based on the double-q model and reasonable qualitative agreement is found. By examining the azimuthal dependence of first-order satellite scattering, we show the magnetic order to be, as predicted, elliptically polarized at base temperature and find the temperature dependence of the "out of a-b plane" moment component to be in fairly good agreement with calculation. Our results provide qualitative support for the double-q model and thus in turn corroborate the explanation for the "magnetoelastic paradox" offered by this model.

cond-mat.mtrl-sci↗

arXiv2010

Crystal-fields in YbInNi4 determined with magnetic form factor and inelastic neutron scattering

The magnetic form factor of YbInNi4 has been determined via the flipping ratios R with polarized neutron diffraction and the scattering function S(Q,w) was measured in an inelastic neutron scattering experiment. Both experiments were performed with the aim to determine the crystal-field scheme. The magnetic form factor clearly excludes the possibility of a \Gamma7 doublet as the ground state. The inelastic neutron data exhibit two, almost equally strong peaks at 3.2 meV and 4.4 meV which points, in agreement with earlier neutron data, towards a \Gamma8 quartet ground state. Further possibilities like a quasi-quartet ground state are discussed.

cond-mat.str-el↗

arXiv2010

Magnetic excitations in multiferroic LuMnO3 studied by inelastic neutron scattering

We present data on the magnetic and magneto-elastic coupling in the hexagonal multiferroic manganite LuMnO3 from inelastic neutron scattering, magnetization and thermal expansion measurements. We measured the magnon dispersion along the main symmetry directions and used this data to determine the principal exchange parameters from a spin-wave model. An analysis of the magnetic anisotropy in terms of the crystal field acting on the Mn is presented. We compare the results for LuMnO3 with data on other hexagonal RMnO3 compounds.

cond-mat.str-el↗

arXiv2009

Magnetic and superconducting transitions in Ba$_{1-x}$K$_x$Fe$_{2}$As$_{2}$ studied by specific heat

We report on specific heat measurements in Ba$_{1-x}$K$_x$Fe$_{2}$As$_{2}$ ($x\le 0.6$). For the underdoped sample with $x=0.2$ both the spin-density-wave transition at $T = 100$ K and the superconducting transition at 23 K can be identified. The electronic contribution to the specific heat in the superconducting state for concentrations in the vicinity of optimal doping $x=0.4$ can be well described by a full single-gap within the BCS limit.

cond-mat.supr-con↗

arXiv2009

New insight into the physics of iron pnictides from optical and penetration depth data

We report theoretical values for the unscreened plasma frequencies Omega_p of several Fe pnictides obtained from DFT based calculations within the LDA and compare them with experimental plasma frequencies obtained from reflectivity data. The sizable renormalization observed for all considered compounds points to the presence of many-body effects beyond the LDA. From the large empirical background dielectric constant of about 12-15, we estimate a large arsenic polarizability of about 9.5 +- 1.2 Angstroem^3 where the details depend on the polarizabilities of the remaining ions taken from the literature. This large polarizability can significantly reduce the value of the Coulomb repulsion U_d about 4 eV on iron known from iron oxides to a level of 2 eV or below. In general, this result points to rather strong polaronic effects as suggested by G.A. Sawatzky et al., in Refs. arXiv:0808.1390 and arXiv:0811.0214 (Berciu et al.). Possible consequences for the conditions of a formation of bipolarons are discussed, too. From the extrapolated muon spin rotation penetration depth data at T= 0 and the experimental Omega_p we estimate the total coupling constant lambda_tot for the el-boson interaction within the Eliashberg-theory adopting a single band approximation. For LaFeAsO_0.9F_0.1 a weak to intermediately strong coupling regime and a quasi-clean limit behaviour are found. For a pronounced multiband case we obtain a constraint for various intraband coupling constants which in principle allows for a sizable strong coupling in bands with either slow electrons or holes.

cond-mat.supr-con↗

arXiv2009

Electronic structure studies of BaFe2As2 by angle-resolved photoemission spectroscopy

We report high resolution angle-resolved photoemission spectroscopy (ARPES) studies of the electronic structure of BaFe$_2$As$_2$, which is one of the parent compounds of the Fe-pnictide superconductors. ARPES measurements have been performed at 20 K and 300 K, corresponding to the orthorhombic antiferromagnetic phase and the tetragonal paramagnetic phase, respectively. Photon energies between 30 and 175 eV and polarizations parallel and perpendicular to the scattering plane have been used. Measurements of the Fermi surface yield two hole pockets at the $\Gamma$-point and an electron pocket at each of the X-points. The topology of the pockets has been concluded from the dispersion of the spectral weight as a function of binding energy. Changes in the spectral weight at the Fermi level upon variation of the polarization of the incident photons yield important information on the orbital character of the states near the Fermi level. No differences in the electronic structure between 20 and 300 K could be resolved. The results are compared with density functional theory band structure calculations for the tetragonal paramagnetic phase.

cond-mat.supr-con↗

arXiv2009

Ab initio lattice dynamics simulations and inelastic neutron scattering spectra for studying phonons in BaFe2As2: Effect of structural phase transition, structural relaxation and magnetic ordering

We have performed extensive ab initio calculations to investigate phonon dynamics and their possible role in superconductivity in BaFe2As2 and related systems. The calculations are compared to inelastic neutron scattering data that offer improved resolution over published data [Mittal et al., PRB 78 104514 (2008)], in particular at low frequencies. Effects of structural phase transition and full/partial structural relaxation, with and without magnetic ordering, on the calculated vibrational density of states are reported. Phonons are best reproduced using either the relaxed magnetic structures or the experimental cell. Several phonon branches are affected by the subtle structural changes associated with the transition from the tetragonal to the orthorhombic phase. Effects of phonon induced distortions on the electronic and spin structure have been investigated. It is found that for some vibrational modes, there is a significant change of the electronic distribution and spin populations around the Fermi level. A peak at 20 meV in the experimental data falls into the pseudo-gap region of the calculation. This was also the case reported in our recent work combined with an empirical parametric calculation [Mittal et al., PRB 78 104514 (2008)]. The combined evidence for the coupling of electronic and spin degrees of freedom with phonons is relevant to the current interest in superconductivity in BaFe2As2 and related systems.

cond-mat.supr-con↗

arXiv2008

Specific heat in different magnetic phases of RNi2B2C (R= Gd, Ho, Er): theory and experiment

The borocarbides RNi2B2C (R=Gd, Ho, Er) exhibit a large variety of magnetic states and as a consequence rich phase diagrams. We have analyzed the nature of these states by specific heat investigations. The data were measured down to 0.5 K and up to 80 kOe. The overall evolution of each Cm(T,H) curve is observed to reflect faithfully the features of the corresponding H-T phase diagram. Within the lower ranges of temperature and fields, the calculations based on linearized field-dependent spin-wave theory are found to reproduce satisfactorily the measured Cm(T,H) curves: accordingly, within these ranges, the thermodynamical properties of these compounds can be rationalized in terms of only two parameters: the spin-wave energy gap and the stiffness coefficient. For the intermediate fields ranges (H1<H<Hsat) wherein successive field-induced metamagnetic modes are stabilized, the evolution of Cm(T,H) is discussed in terms of the Maxwell relation (dCm/dH)T=T(d^2M/dT^2)H. For the particular case of GdNi2B2C wherein the anisotropy is dictated by the classical dipole interaction, Cm(T,H) across the whole ordered state is numerically evaluated within the model of Jensen and Rotter [PRB 77 (2008) 134408].

cond-mat.str-el↗

arXiv2008

Neutron diffraction on antiferromagnetic ordering in single-crystal BaFe2As2

Neutron diffraction experiments have been carried out on a Sn-flux grown BaFe2As2 single crystal, the parent compound of the A-122 family of FeAs-based high-Tc superconductors. A tetragonal to orthorhombic structural phase transition and a three dimensional long-range antiferromagnetic ordering of the iron moment, with a unique magnetic propagation wavevector k = (1, 0, 1), have been found to take place at ~90 K. The magnetic moments of iron are aligned along the long a axis in the low temperature orthorhombic phase (Fmmm with b<a<c). Our results thus demonstrate that the magnetic structure of BaFe2As2 single crystal is the same as those in other A-122 iron pnictides compounds. We argue that the tin incorporation in the lattice is responsible for a smaller orthorhombic splitting and lower Neel temperature T_N observed in the experiment.

cond-mat.supr-con↗