arXiv subjects

Daniel G. Mazzone

Publications and source records attributed to Daniel G. Mazzone.

17 recordsLinked to original sources

arXiv2026

$d$-wave altermagnetism revealed by resonant inelastic X-ray scattering

Altermagnetism defines a third fundamental class of collinear magnetic order, featuring compensated magnetic moments with antiparallel spin alignment, yet lifted Kramers degeneracy without the need for relativistic spin-orbit coupling. Its ability to host spin-polarized electronic bands and unconventional chiral magnons makes it a promising platform for functional materials. However, experimental verification has proven challenging; while circular dichroism in resonant inelastic X-ray scattering (RIXS) has been suggested as a signature of chiral magnons, it remains controversial whether this effect is an intrinsic property of altermagnetism or an artifact of experimental geometry. In this work, we resolve this debate and provide unambiguous experimental evidence of $d$-wave altermagnetism in the strongly correlated Lieb-lattice magnet La$_2$O$_3$Mn$_2$Se$_2$. The RIXS spectra exhibit a $d$-wave-symmetry circular dichroism in the magnetic excitations that vanishes in the paramagnetic phase. Through RIXS-operator symmetry analysis and exact-diagonalization calculations, we prove that the observed dichroism is a direct consequence of altermagnetic symmetry constraints, independent of magnon branch splitting. Our results provide definitive evidence for the experimental realization of $d$-wave altermagnetism in La$_2$O$_3$Mn$_2$Se$_2$ and establish circularly polarized RIXS as a highly symmetry-sensitive spectroscopic framework for detecting magnetic phases that evade conventional probes.

cond-mat.str-el↗

arXiv2026

Accelerating discovery across scientific disciplines through reproducible workflows with AiiDAlab

With ever-increasing computational capabilities, robust and automated research workflows have become essential for orchestrating large numbers of interdependent simulations. However, significant technical expertise is still required to configure execution environments, define calculation inputs, interpret outputs, and manage the complexity of parallel code execution on remote machines. To address these challenges, we developed AiiDAlab, a Jupyter-based web platform powered by the AiiDA computational infrastructure that provides a framework for managing and automating computational workflows while ensuring reproducibility through full provenance tracking. Through a collection of open-source user-friendly applications, AiiDAlab enables scientists to set up, execute, and analyze complex computational workflows without interacting directly with the underlying technical details, allowing them to focus on their research questions. In this paper, we discuss how AiiDAlab has matured over the past few years, expanding beyond computational materials science and its AiiDA origins. We present recent developments towards integrating with electronic laboratory notebooks (ELNs) for FAIR-compliant data management, adoption in large-scale facilities for secure access to experimental data and analytical tools, and applications in educational settings. Together with community-driven efforts to simplify onboarding, improve access to computational resources, and support large-scale data workflows, these advancements position AiiDAlab as a powerful platform for accelerating scientific discovery and fostering collaboration across disciplines.

cs.DC↗

arXiv2026

Coherent spin waves in a maximal entropy phase

In solids, disorder is conventionally regarded as detrimental to coherence. It typically localizes and dampens collective excitations, as exemplified by Anderson localization or the broadening of magnetic modes in systems lacking long-range order. While high-entropy materials are specifically designed to harness disorder and stabilize homogeneous mixed-phase structures that can display unique properties, this same disorder is nonetheless expected to preclude the formation of coherent magnetic excitations. To test the limits of this picture, we selected the antiferromagnetic system YBaCuFeO5, as it features two distinct transition metal atoms with significantly different magnetic moments, rendering its spin dynamics exceptionally sensitive to local atomic ordering. Combining resonant inelastic x-ray scattering and linear spin wave theory, we reveal a surprising paradox: YBaCuFeO5 exhibits an unexpected, entropy-driven mixed phase, in which disorder, rather than reducing the lifetime of the collective excitations, favors coherence. In this mixed phase, the spin waves remain dispersive, markedly distinct from those expected for an ordered ground state, and exhibit well-defined acoustic and optical branches separated by a large optical gap. These results demonstrate that in entropy-stabilized magnets, disorder can favor coherent collective modes previously thought to be exclusive to low-entropy systems.

cond-mat.str-el↗

arXiv2026

Field-direction sensitivity of Kondo hybridization in UTe$_2$

Neutron scattering experiments on the spin-triplet superconductor UTe$_2$ have established that the dominant low-energy magnetic response is along Brillouin zone boundaries, resembling the magnetic susceptibility of narrow-gap interband excitations. We report a study of the sensitivity of these excitations to magnetic field along the crystallographic $\hat{a}$-axis. Up to fields of $μ_0 H$=13 T, the maximal inelastic neutron spectral weight increases in energy transfer, with a pronounced increase in $d\hbarω_{peak}/dH$ near $μ_0 H$=7 T. This behavior parallels the field and temperature dependent features of the electrical resistivity that are associated with Kondo hybridization. Our measurements suggest that $\hat{a}$-axis fields near $μ_0 H$=7~T induce a change in the hybridization between heavy $f$-electrons and the bare conduction band.

cond-mat.str-el↗

arXiv2026

A Fermi Surface Driven Spiral Spin Liquid

EuAg$_4$Sb$_2$ is a model material to study the interplay of electronic and spin texture degrees of freedom, exhibiting numerous multi-$q$ magnetic textures coupled with the electronic properties. It is generally understood that some combination of conduction-electron mediated interactions, frustration, and higher order interactions are responsible for complex incommensurate spin textures in centrosymmetric lanthanide materials. Here, we refine an effective model of the magnetic interactions in EuAg$_4$Sb$_2$ through measurements of diffuse magnetic neutron scattering above the ordering temperature. These diffuse measurements reveal a ring of fluctuating spin modulations that reflects a manifold of nearly degenerate propagation vectors known as a spiral spin liquid (SSL). We further identify that this approximate $U$(1) symmetric SSL emerges from magnetic interactions mediated by a quasi-2D hole pocket and exhibits critical scaling of the spatial correlations. Further, Monte Carlo simulations reveal excellent agreement with experiment and provide a comprehensive understanding of the phase diagram. This study emphasizes the connection between the rich spin textures in this material, the electronic structure, and spin liquidity$\unicode{x2014}$uncovering new insights into design principles for nano-scale spin texture materials with advantageous intertwined electronic, magnetic, and topological properties, and new mechanisms for generating the physics of spiral spin liquids.

cond-mat.str-el↗

arXiv2025

Topological Metal-Insulator Transition within the Ferromagnetic state

A major challenge in condensed matter physics is integrating topological phenomena with correlated electron physics to leverage both types of states for next-generation quantum devices. Metal-insulator transitions (MITs) are central to bridging these two domains while simultaneously serving as 'on-off' switches for electronic states. Here, we demonstrate how the prototypical material of K2Cr8O16 undergoes a ferromagnetic MIT accompanied by a change in band topology. Through inelastic x-ray and neutron scattering experiments combined with first-principles theoretical calculations, we demonstrate that this transition is not driven by a Peierls mechanism, given the lack of phonon softening. Instead, we establish the transition as a topological MIT within the ferromagnetic phase (topological-FM-MIT) with potential axionic properties, where electron correlations play a key role in stabilizing the insulating state. This work pioneers the discovery of a topological-FM-MIT and represents a fundamentally new class of topological phase transitions, revealing a unique pathway through which magnetism, topology, and electronic correlations interact.

cond-mat.str-el↗

arXiv2025

AMBER: Algorithm for Multiplexing spectrometer Background Estimation with Rotation-independence

State-of-the art neutron spectrometers enable simultaneous measurements of high-dimensional datasets, allowing for a large collection rate of dynamic material properties. In this paper, we present the Algorithm for Multiplexing spectrometer Background Estimation with Rotation-independence (AMBER), which is a segmentation algorithm designed to decompose measured neutron scattering data into model-agnostic foreground and background contributions. The method takes advantage of the fact that background and foreground signals are measured simultaneously during the data collection process, relying on rotational independence of background contributions. The algorithm, initially developed for multiplexing neutron spectrometers, aims to strongly reduce time consuming expert input, therefore promoting full data set usage while minimizing the source of systematic errors.

physics.ins-det↗

arXiv2025

Spin density wave and van Hove singularity in the kagome metal CeTi3Bi4

Kagome metals with van Hove singularities near the Fermi level can host intriguing quantum phenomena such as chiral loop currents, electronic nematicity, and unconventional superconductivity. However, to our best knowledge, unconventional magnetic states driven by van Hove singularities--like spin-density waves--have not been observed experimentally in kagome metals. Here, we report the magnetic and electronic structure of the layered kagome metal CeTi3Bi4, where Ti kagome electronic structure interacts with a magnetic sublattice of Ce3+ Jeff = 1/2 moments. Neutron diffraction reveals an incommensurate spin-density wave ground state of the Ce3+ moments, coexisting with commensurate antiferromagnetic order across most of the temperature-field phase diagram. The commensurate component is preferentially suppressed by thermal fluctuations and magnetic field, yielding a rich phase diagram involving an intermediate single-Q spin-density wave phase. First-principles calculations and angle-resolved photoemission spectroscopy identify van Hove singularities near the Fermi level, with the observed magnetic propagation vectors connecting their high density of states, strongly suggesting a van Hove singularity-assisted spin-density wave. These findings establish kagome metals LnTi3Bi4 as a model platform where the characteristic electronic structure of the kagome lattice plays a pivotal role in magnetic order.

cond-mat.str-el↗

arXiv2024

Absence of altermagnetic magnon band splitting in MnF$_2$

Altermagnets are collinear compensated magnets in which the magnetic sublattices are related by rotation rather than translation or inversion. One of the quintessential properties of altermagnets is the presence of split chiral magnon modes. Recently, such modes have been predicted in MnF$_2$. Here, we report inelastic neutron scattering results on an MnF$_2$ single-crystal along high-symmetry Brillouin zone paths for which the magnon splitting is expected. Within the resolution of our measurement, we do not observe the predicted splitting. The inelastic spectrum is well-modeled using $J_1, ~J_2, ~J_3$ nearest-neighbor exchange interactions with weak uniaxial anisotropy. These interactions have higher symmetry than the crystal lattice, while the interactions predicted to produce the altermagnetic splitting are negligibly small. Therefore, the two magnon modes appear to be degenerate over the entire Brillouin zone and the spin dynamics of MnF$_2$ is indistinguishable from a classical Néel antiferromagnet. Application of magnetic field causes a Zeeman splitting of the magnon modes close to the $\mathrmΓ$ point. Even if chiral magnon modes are allowed by altermagnetic symmetry, the splitting in real materials such as MnF$_2$ can be negligibly small.

cond-mat.str-el↗

arXiv2024

Magnetic Phase Diagram of ErB$_4$ as Explored by Neutron Scattering

The tetragonal $4f$-electron intermetallic ErB$_4$ is characterized by strong Ising anisotropy along the tetragonal $c$ axis. The magnetic moments on the erbium sites can be mapped onto a Shastry-Sutherland (SSL) lattice resulting in geometrical frustration. At zero magnetic field ErB$_4$ exhibits collinear columnar antiferromagnetic (CAFM) order below $T_\text{N} = 15.4$ K. In the presence of a magnetic field parallel to the $c$ axis, ErB$_4$ exhibits a plateau at $1/2$ of the saturation magnetization $M_\text{S}$, which arises at a spin flip transition at $H_1$ $=$ 1.9 T. Fractional magnetization plateaus and other exotic spin phases are a well-established characteristic feature of frustrated spin systems. Monte Carlo simulations propose that ErB$_4$ is an ideal candidate to feature a spin supersolid phase in close vicinity of $H_1$ between the CAFM and $M/M_\text{S}=1/2$ plateau (HP) phase. Here we combine single-crystal neutron diffraction and inelastic neutron scattering to study the magnetic phase diagram and the crystal electric field (CEF) ground state of ErB$_4$. Our measurements as a function of magnetic field find no signature of the spin supersolid phase but allow us to determine the magnetic structure of the HP phase to be of the uuud type consistent with an Ising material. The magnetic moment $μ_{\mathrm{CEF}}$ $=$ 8.96 $μ_B$ expected from the CEF configuration determined by our inelastic neutron scattering measurements is also consistent with the ordered moment observed in neutron diffraction showing that the moments are fully ordered and close to the Er$^{3+}$ free ion moment (9.6 $μ_B$).

cond-mat.str-el↗

arXiv2024

Connection between f-electron correlations and magnetic excitations in UTe2

The detailed anisotropy of the low-temperature, low-energy magnetic excitations of the candidate spin-triplet superconductor UTe$_2$ is revealed using inelastic neutron scattering. The magnetic excitations emerge from the Brillouin zone boundary at the high symmetry $Y$ and $T$ points and disperse along the crystallographic $\hat{b}$-axis. In applied magnetic fields to at least $μ_0 H=11$~T along the $\hat{c}-$axis, the magnetism is found to be field-independent in the $(hk0)$ plane. The scattering intensity is consistent with that expected from U$^{3+}$/U$^{4+}$ $f$-electron spins with preferential orientation along the crystallographic $\hat{a}$-axis, and a fluctuating magnetic moment of 2.3(7) $μ_B$. These characteristics indicate that the excitations are due to intraband spin excitons arising from $f$-electron hybridization.

cond-mat.str-el↗

arXiv2024

Spectral evidence for Dirac spinons in a kagome lattice antiferromagnet

Emergent quasiparticles with a Dirac dispersion in condensed matter systems can be described by the Dirac equation for relativistic electrons, in analogy with Dirac particles in high-energy physics. For example, electrons with a Dirac dispersion have been intensively studied in electronic systems such as graphene and topological insulators. However, charge is not a prerequisite for Dirac fermions, and the emergence of Dirac fermions without charge degree of freedom has been theoretically predicted to be realized in Dirac quantum spin liquids. These quasiparticles carry a spin of 1/2 but are charge-neutral, and so are called spinons. Here we show that the spin excitations of a kagome antiferromagnet, YCu$_3$(OD)$_6$Br$_2$[Br$_{0.33}$(OD)$_{0.67}$], are conical with a spin continuum inside, which is consistent with the convolution of two Dirac spinons. The predictions of a Dirac spin liquid model with a spinon velocity obtained from the spectral measurements are in agreement with the low-temperature specific heat of the sample. Our results thus provide spectral evidence for the Dirac quantum spin liquid state emerging in this kagome lattice antiferromagnet. However, the locations of the conical spin excitations differ from those calculated by the nearest neighbor Heisenberg model, suggesting the Dirac spinons have an unexpected origin.

cond-mat.str-el↗

arXiv2023

Commissioning of the novel Continuous Angle Multi-Energy Analysis Spectrometer at the Paul Scherrer Institut

We report on the commissioning results of the cold neutron multiplexing secondary spectrometer CAMEA (\textbf{C}ontinuous \textbf{A}ngle \textbf{M}ulti-\textbf{E}nergy \textbf{A}nalysis) at the Swiss Spallation Neutron Source (SINQ) at the Paul Scherrer Institut, Switzerland. CAMEA is optimized for an efficient data acquisition of scattered neutrons in the horizontal scattering plane, allowing for detailed and rapid mapping of low-energy excitations under extreme sample environment conditions.

physics.ins-det↗

arXiv2022

Non-thermal breaking of magnetic order via photo-generated spin defects

In Mott insulators the evolution of antiferromagnetic order to superconducting or charge-density-wave-like states upon chemical doping underpins the control of quantum phases. Photo-doping can induce similar transitions on the ultrafast timescale, however the response of the spin system has remained elusive. Here, we use 4D-ultrafast optical spectroscopy to extract quantitative magnetic dynamics in the spin-orbit coupled Mott insulator Sr3Ir2O7. We demonstrate that light can non-thermally melt long-range spin order. At low fluences magnetic order recovers within 1 ps despite demagnetization of roughly 50%. However, high fluences induce a crossover to a long-lived demagnetized state without increasing the lattice temperature. We show that the generation of photo-induced spin defects enables a mechanism that stabilizes the demagnetized state which could help expose new transient phases.

cond-mat.str-el↗

arXiv2020

MJOLNIR: A Software Package for Multiplexing Neutron Spectrometers

Novel multiplexing triple-axis neutron scattering spectrometers yield significant improvements of the common triple-axis instruments. While the planar scattering geometry keeps ensuring compatibility with complex sample environments, a simultaneous detection of scattered neutrons at various angles and energies leads to tremendous improvements in the data acquisition rate. Here we report on the software package MJOLNIR that we have developed to handle the resulting enhancement in data complexity. Using data from the new CAMEA spectrometer of the Swiss Spallation Neutron Source at the Paul Scherrer Institut, we show how the software reduces, visualises and treats observables measured on multiplexing spectrometers. The software package has been generalised to a uniformed framework, allowing for collaborations across multiplexing instruments at different facilities, further facilitating new developments in data treatment, such as fitting routines and modelling of multi-dimensional data.

physics.data-an↗

arXiv2020

Phonons, Q-dependent Kondo spin fluctuations, and 4$\textit{f}$/phonon resonance in YbAl$_3$

The intermediate valence (IV) compound YbAl$_3$ exhibits nonintegral valence (Yb 4$f^{14-n_f}$ (5d6s)$^z$ where z = 2+n$_f$ = 2.75) in a moderately heavy (m* = 20-30me) ground state with a large Kondo temperature (T$_K$ ~ 500-600K). We have measured the magnetic fluctuations and the phonon spectra on single crystals of this material by time-of-flight inelastic neutron scattering (INS) and inelastic x-ray scattering (IXS). We find that at low temperature, the Kondo-scale spin fluctuations have a momentum (Q) dependence similar to that seen recently in the IV compound CePd$_3$ and which can be attributed to particle-hole excitations in a coherent itinerant 4$f$ correlated ground state. The Q-dependence disappears as the temperature is raised towards room temperature and the 4$f$ electron band states become increasingly incoherent. The measured phonons can be described adequately by a calculation based on standard DFT+$U$ density functional theory, without recourse to considering 4$f$ correlations dynamically. A low temperature magnetic peak observed in the neutron scattering at ~ 30meV shows dispersion identical to an optic phonon branch. This 4$f$/phonon resonance disappears for T > 150K. The phonons appear to remain unaffected by the resonance. We discuss several possibilities for the origin of this unusual excitation, including the idea that it arises from the large amplitude beating of the light Al atoms against the heavy Yb atoms, resulting in a dynamic 4$f$/3$p$ hybridization.

cond-mat.str-el↗

arXiv2019

Exploring itinerant states in divalent hexaborides using rare-earth $L$ edge resonant inelastic X-ray scattering

We present a study of resonant inelastic X-ray scattering (RIXS) spectra collected at the rare-earth $L$ edges of divalent hexaborides YbB$_6$ and EuB$_6$. In both systems, RIXS-active features are observed at two distinct resonances separated by $\sim10$ eV in incident energy, with angle-dependence suggestive of distinct photon scattering processes. RIXS spectra collected at the divalent absorption peak strongly resemble the unoccupied 5$d$ density of states calculated using density functional theory, an occurrence we ascribe to transitions between weakly-dispersing 4$f$ and strongly dispersing 5$d$ states. In addition, anomalous resonant scattering is observed at higher incident energy, where no corresponding absorption feature is present. Our results suggest the far-reaching utility of $L$-edge RIXS in determining the itinerant-state properties of $f$-electron materials.

cond-mat.str-el↗