arXiv subjects

Jaime M. Moya

Publications and source records attributed to Jaime M. Moya.

17 recordsLinked to original sources

arXiv2026

Competing collinear and non-collinear spin textures imaged by spatially-resolved REXS in Eu(Al0.4Ga0.6)4

Here, we use resonant elastic x-ray scattering (REXS) to investigate the inhomogeneity of the zero-field magnetic spin texture of Eu(Al$_{0.4}$Ga$_{0.6}$)$_4$. By using spatially-resolved REXS, we show that the two magnetic transitions at T$_{N1}$ = 17 K and T$_{N2}$ = 14 K originate from two nearly degenerate, yet distinct, orthogonal pairs of q-vectors. The corresponding phases are segregated spatially, such that one fraction of the sample comprises coexisting orthogonal spin-density-wave domains, while another fraction hosts coexisting orthogonal helical domains. Additionally, the helical state forms inversion domains indicating that the inversion symmetry is not broken prior the magnetic transition. Our results suggest that the magnetic state is single-q and revealed a large variation of spin textures across a 0.8 - 1 mm area of the sample surface. These results demonstrate clear differences between the locally and globally probed magnetic textures, typically assumed to be representative of the system as a whole, highlighting the importance of spatially-resolved probes for accurately describing the magnetic behavior of this class of materials.

cond-mat.str-el↗

arXiv2026

Chiral, Electronically Decoupled Layers of 1T'-WS2 Topological Insulator via Neutral-Molecule Intercalation

Monolayer 1T'-WS2 is predicted to be a two-dimensional topological insulator, but its intrinsic electronic properties are masked by strong interlayer coupling in its metallic and superconducting bulk parent phase, 2M-WS2. Isolating monolayers by mechanical exfoliation is also hindered by this coupling, preventing experimental examination of monolayer properties. Here we show that 2M-WS2 undergoes amine intercalation through a simple wet-chemical reaction, yielding superlattices in which the 1T' layers are structurally preserved but electronically decoupled by neutral molecular spacers. Intercalation expands the interlayer spacing from 0.5 to 1-4 nm and reconstructs the stacking while preserving the intralayer 1T' framework. Controlled (de)intercalation reversibly switches the system between a superconducting metal and an insulator with an activation gap matching that of the isolated monolayer. Density functional theory indicates that the electronically decoupled layers retain the nontrivial Z2 topology of the monolayer. Chiral amine intercalation further induces chiroptical activity in WS2 electronic transitions. Overall, the successful intercalation challenges the long-held view that group VIB dichalcogenides are inert toward neutral-molecule intercalation and demonstrates molecular intercalation as a general chemical route for realizing monolayer-like topological-insulator physics and enabling chiral van der Waals superlattices in bulk single crystals.

cond-mat.mtrl-sci↗

arXiv2026

New Superconductors in the PtPb$_3$Bi Structure Type

The quest for new superconductors is of both fundamental and technological importance. Recently, an artificial intelligence method correctly predicted PtPb$_3$Bi to be a superconductor. In this work, we find superconductivity in the newly synthesized $M$Pb$_{4-x}$Bi$_x$ ($M$ = Au, Pd, and Rh), of which PtPb$_3$Bi is a member. When $M$ = Ni, whose radius is considerably smaller, the structure instead collapses into the different, Pb-substituted NiBi$_3$ type. Interestingly, the stoichiometric parameter $x$ shifts across the three compounds to keep the total valence electron count close to 20 per formula unit. The superconducting transitions occur at 4.9, 4.2, and 3.4 K, for $M$ = Au, Pd, and Rh, respectively. Using electrical resistivity, magnetization, and specific heat measurements, we establish the bulk nature of the superconducting state and determine the critical fields, characteristic length scales, and anisotropy ratios. All three compounds are moderately anisotropic type-II superconductors, with modest upper critical field anisotropies of $H_{c2}^{\parallel c}/H_{c2}^{\perp c} \approx 1.2$ to $1.5$. These results establish $M$Pb$_{4-x}$Bi$_x$ as a family of anisotropic superconductors and a platform for studying how site disorder and Pb-Bi mixing govern superconductivity in heavy-element intermetallics.

cond-mat.supr-con↗

arXiv2026

New Crystal Structures Hide in Plain Sight: A Stress Test for AI-Guided Materials Discovery

New types of crystal structures are discovered only rarely, and the artificial intelligence (AI) models now reshaping materials discovery have so far produced new chemical compositions within known structural families rather than genuinely new structures. We report GdNiSn4 and LuNiSn4, intermetallics that adopt a previously unreported structure type, found not by computation but by exploratory synthesis. Single-crystal diffraction shows that the structure is an intergrowth of two known structural units. We then use this system as a benchmark for two leading generative models, MatterGen and DiffCSP++. For DiffCSP++, the benchmark is performed in its crystallographically constrained setting, using the required space-group and Wyckoff-position inputs. Under our sampling budget, neither model recovers the experimentally reported monoclinic structure within the structural-matching tolerance. The generated structures are evaluated without further structural relaxation using the nonmagnetic analog LuNiSn4, where we rule out 4f magnetism as the cause. Because the new structure is built from familiar building blocks, it should be derivable. We argue that encoding chemical reasoning, such as the stacking of known motifs, is a concrete path toward AI that can discover structurally novel materials.

cond-mat.mtrl-sci↗

arXiv2026

Modification of Charge and Spin Textures by Light Chemical Substitution in Eu(Al$_{1-x}$Ga$_{x}$)$_4$ ($x=0.1$)

We present the results of a resonant X-ray diffraction experiment, resolving both charge and spin textures in the intermetallic topological magnet Eu(Al$_{1-x}$Ga$_{x}$)$_4$, $x$ = 0.1. Below $\approx$ 75 K the system develops a charge density wave (CDW) with propagation vector kCDW ~ (0, 0, 0.18). The CDW order parameter grows monotonically on cooling until ~ 15 K, when a sudden decrease in the CDW amplitude occurs. Pairs of magnetic satellites of the (0, 0, 8) Bragg reflection corresponding to two distinct domains, k = ($\pm δ_\text{m}$, 0, 0), k2 = (0, $\pmδ_\text{m}$, 0), $δ_\text{m} = 0.2002(4)$ were studied at the Eu L3 edge, appearing below TN = 14.8 K. Our measurement of TN is exactly coincident with the sudden drop in the CDW amplitude, which suggests strong coupling between the charge and spin orders, as observed in other compounds of the Eu(Al$_{1-x}$Ga$_{x}$)$_4$ series. Azimuthal measurements revealed a single helical spin arrangement with an elliptical envelope of $μ_\text{Y}/μ_\text{Z}$ = 1.19(6) for the k2 domain, and a tilted helical (helicoidal) spin arrangement for the k1 domain, with $μ_\text{Y}/μ_\text{Z}$ = 1.14(4) and $μ_\text{X}/μ_\text{Z}$ = 0.20(2) that may be hidden for the k2 domain due to multiple subdomains. Temperature evolution of the magnetic satellite intensities in linear and circularly polarised light found the respective ratio to be invariant with temperature, suggesting a single magnetic phase below TN. This behaviour is unlike the x = 0 material, in which a spin density wave forms first, transitioning to a helical ground state on cooling through intermediate phases. Future theoretical work on the Eu electronic ground state, supported by related experiments, will help understand the effects of Ga substitution on the evolution of the magnetic structure.

cond-mat.str-el↗

arXiv2026

Measuring the Hall effect in hysteretic materials

Measurement of the Hall effect is a ubiquitous probe for materials discovery, characterization, and metrology. Inherent to the Hall measurement geometry, the measured signal is often contaminated by unwanted contributions, so the data must be processed to isolate the Hall response. The standard approach invokes Onsager-Casimir reciprocity and antisymmetrizes the raw signal about zero applied magnetic field. In hysteretic materials this becomes nontrivial, since Onsager-Casimir relations apply only to microscopically reversible states. Incorrect antisymmetrization can lead to artifacts that mimic anomalous or topological Hall signatures. The situation is especially subtle when hysteresis loops are not centered at zero applied field, as in exchange-biased systems. A practical reference for generically extracting the Hall response in hysteretic materials is lacking. Here, using Co$_3$Sn$_2$S$_2$ as a bulk single-crystal model that can be prepared with or without exchange-biased hysteresis, we demonstrate two procedures that can be used to extract the Hall effect: (1) reverse-magnetic-field reciprocity and (2) antisymmetrization with respect to applied field. We then measure the Hall effect on CeCoGe$_3$, a noncentrosymmetric antiferromagnet which can be prepared to have asymmetric magnetization and magnetoresistance, and demonstrate how improper processing can generate artificial anomalous Hall signals. These methods are generic and can be applied to any conductor.

cond-mat.str-el↗

arXiv2026

Tunable magnetotransport through kinetically hindered first-order phase transitions in an antiferromagnetic metal

Controllable multilevel resistance states are of interest for memory technologies like neuromorphic computing, but robust materials platforms toward such behavior remain limited. Here, we show that the non-centrosymmetric antiferromagnetic metal CeCoGe$_3$ suggests one such route through a kinetically hindered first-order magnetic transition. Cooling through the kinetically hindered first-order transition in an applied magnetic field produces a magnetic glass state in which high- and low-temperature magnetic phases coexist. The relative fraction of these phases can be controlled by the applied field in which the sample is cooled, and the electrical resistance is directly sensitive to that fraction. As a result, it is demonstrated that CeCoGe$_3$ supports stable multilevel resistive states. These results identify kinetically hindered first-order phase transitions as a promising route towards controllable multilevel magnetoresistive states.

cond-mat.str-el↗

arXiv2025

Correlation between Complex Spin Textures and the Magnetocaloric and Hall Effects in Eu(Ga$_{1-x}$Al$_x$)$_4$ ($x$ = 0.9, 1)

Determining the electronic phase diagram of a quantum material as a function of temperature (T) and applied magnetic field (H) forms the basis for understanding the microscopic origin of transport properties, such as the anomalous Hall effect (AHE) and topological Hall effect (THE). For many magnetic quantum materials, including EuAl$_4$, a THE arises from a topologically protected magnetic skyrmion lattice with a non-zero scalar spin chirality. We identified a square skyrmion lattice (sSkL) peak in Eu(Ga$_{1-x}$Al$_x$)$_4$ ($x$ = 0.9) identical to the peak previously observed in EuAl$_4$ by performing neutron scattering measurements throughout the phase diagram. Comparing these neutron results with transport measurements, we found that in both compounds the maximal THE does not correspond to the sSkL area. Instead of the maximal THE, the maximal magnetocaloric effect (MCE) boundaries better identify the sSkL lattice phase observed by neutron scattering measurements. The maximal THE therefore arises from interactions of itinerant electrons with frustrated spin fluctuations in a topologically trivial magnetic state.

cond-mat.str-el↗

arXiv2024

Bonding Interactions Can Drive Topological Phase Transitions in a Zintl Antiferromagnetic Insulator

While $\sim$30% of materials are reported to be topological, topological insulators are rare. Magnetic topological insulators (MTI) are even harder to find. Identifying crystallographic features that can host the coexistence of a topological insulating phase with magnetic order is vital for finding intrinsic MTI materials. Thus far, most materials that are investigated for the determination of an MTI are some combination of known topological insulators with a magnetic ion such as MnBi$_2$Te$_4$. Motivated by the recent success of EuIn$_{2}$As$_{2}$, we investigate the role of chemical pressure on topologically trivial insulator, Eu$_5$In$_2$Sb$_6$ via Ga substitution. Eu$_5$Ga$_2$Sb$_6$ is predicted to be topological but is synthetically difficult to stabilize. We look into the intermediate compositions between Eu$_5$In$_2$Sb$_6$ and Eu$_5$Ga$_2$Sb$_6$ through theoretical works to explore a topological phase transition and band inversion mechanism. We attribute the band inversion mechanism to changes in Eu-Sb hybridization as Ga is substituted for In due to chemical pressure. We also synthesize Eu$_{5}$In$_{4/3}$Ga$_{2/3}$Sb$_{6}$, the highest Ga concentration in Eu$_{5}$In$_{2-x}$Ga$_{x}$Sb$_{6}$, and report the thermodynamic, magnetic, transport, and Hall properties. Overall, our work paints a picture of a possible MTI via band engineering and explains why Eu-based Zintl compounds are suitable for the co-existence of magnetism and topology.

cond-mat.mtrl-sci↗

arXiv2024

Quantum Simulation of an Extended Dicke Model with a Magnetic Solid

The Dicke model describes the cooperative interaction of an ensemble of two-level atoms with a single-mode photonic field and exhibits a quantum phase transition as a function of light--matter coupling strength. Extending this model by incorporating short-range atom--atom interactions makes the problem intractable but is expected to produce new phases. Here, we simulate such an extended Dicke model using a crystal of ErFeO$_3$, where the role of atoms (photons) is played by Er$^{3+}$ spins (Fe$^{3+}$ magnons). Through magnetocaloric effect and terahertz magnetospectroscopy measurements, we demonstrated the existence of a novel atomically ordered phase in addition to the superradiant and normal phases that are expected from the standard Dicke model. Further, we elucidated the nature of the phase boundaries in the temperature--magnetic-field phase diagram, identifying both first-order and second-order phase transitions. These results lay the foundation for studying multiatomic quantum optics models using well-characterized many-body condensed matter systems.

quant-ph↗

arXiv2023

Symmetry-mode analysis for local structure investigations using pair distribution function data

Symmetry-adapted distortion modes provide a natural way to describe distorted structures derived from higher-symmetry parent phases. Structural refinements using symmetry-mode amplitudes as fit variables have been used for at least 10 years in Rietveld refinements of the average crystal structure from diffraction data; more recently, this approach has also been used for investigations of the local structure using real-space pair distribution function (PDF) data. Here, we further demonstrate the value of performing symmetry-mode fits to PDF data through the successful application of this method to two topical materials: TiSe$_2$, where we detect the subtle but long-range structural distortion driven by the formation of a charge density wave, and MnTe, where we characterize a large but highly localized structural distortion in terms of symmetry-lowering displacements of the Te atoms. The analysis is performed using fully open-source code within the DiffPy framework using two packages we developed for this work: isopydistort, which provides a scriptable interface to the ISODISTORT web application for group theoretical calculations, and isopytools, which converts the ISODISTORT output into a DiffPy-compatible format for subsequent fitting and analysis. These developments expand the potential impact of symmetry-adapted PDF analysis by enabling high throughput analysis and removing the need for any commercial software.

cond-mat.mtrl-sci↗

arXiv2023

Real-space and reciprocal-space topology in the Eu(Ga$_{1-x}$Al$_x$)$_4$ square net system

Magnetotransport measurements on the centrosymetric square-net Eu(Ga$_{1-x}$Al$_x$)$_4$ compounds reveal evidence for both reciprocal- and real-space topology. For compositions $0.50 \leq x \leq 0.90$, several intermediate field phases are found by magnetization measurements when $H \parallel c$, where a maximum in the topological Hall effect (THE) is observed, pointing to the existence of topological (real-space topology) or non-coplanar spin textures. For $0.25 \leq x \leq 0.39$, magnetization measurements reveal an intermediate field state, but no transition is visible in the Hall measurements. For $x = 0.15$, only one magnetic transition occurs below the Néel temperature $T_N$, and no intermediate field spin reorientations are observed. The Hall effect varies smoothly before the spin-polarized (SP) state. However, in the SP state, Hall measurements reveal a large anomalous Hall effect (AHE) for all compositions, a consequence of reciprocal-space topology. Density functional theory calculations in the paramagnetic state indeed reveal a Dirac point that lies very near the Fermi energy, which is expected to split into Weyl nodes in the SP state, thereby explaining the observed AHE. These results suggest the Eu(Ga$_{1-x}$Al$_x$)$_4$ family is a rare material platform where real- and reciprocal-space topology exist in a single material platform.

cond-mat.mtrl-sci↗

arXiv2022

Weyl nodal ring states and Landau quantization with very large magnetoresistance in square-net magnet EuGa$_4$

Magnetic topological semimetals (TSMs) allow for an effective control of the topological electronic states by tuning the spin configuration, and therefore are promising materials for next-generation electronic and spintronic applications. Of magnetic TSMs, Weyl nodal-line (NL) semimetals likely have the most tunability, and yet they are the least experimentally studied so far due to the scarcity of material candidates. Here, using a combination of angle-resolved photoemission spectroscopy and quantum oscillation measurements, together with density functional theory calculations, we identify the square-net compound EuGa4 as a new magnetic Weyl nodal ring (NR) semimetal, in which the line nodes form closed rings in the vicinity of the Fermi level. Remarkably, the Weyl NR states show distinct Landau quantization with clear spin splitting upon application of a magnetic field. At 2 K in a field of 14 T, the transverse magnetoresistance of EuGa4 exceeds 200,000%, which is more than two orders of magnitude larger than that of other known magnetic TSMs. High field magnetoresistance measurements indicate no saturation up to 40 T. Our theoretical model indicates that the nonsaturating MR naturally arises as a consequence of the Weyl NR state. Our work thus point to the realization of Weyl NR states in square-net magnetic materials, and opens new avenues for the design of magnetic TSMs with very large magnetoresistance.

cond-mat.mtrl-sci↗

arXiv2022

Incommensurate magnetic orders and topological Hall effect in the square-net centrosymmetric EuGa$_2$Al$_2$ system

Neutron diffraction on the centrosymmetric square-net magnet EuGa$_2$Al$_2$ reveals multiple incommensurate magnetic states (AFM1,2,3) in zero field. In applied field, a new magnetic phase (A) is identified from magnetization and transport measurements, bounded by two of the $μ_0H$~=~0 incommensurate magnetic phases (AFM1,helical and AFM3, cycloidal) with different moment orientations. Moreover, magneto-transport measurements indicate the presence of a topological Hall effect, with maximum values centered in the A phase. Together, these results render EuGa$_2$Al$_2$ a material with non-coplanar or topological spin texture in applied field. X-ray diffraction reveals an out-of-plane (OOP) charge density wave (CDW) below $T_{CDW} \sim$ 50 K while the magnetic propagation vector lies in plane below $T_N$ = 19.5 K. Together these data point to a new route to realizing in-plane non-collinear spin textures through an OOP CDW. In turn, these non-collinear spin textures may be unstable against the formation of topological spin textures in an applied field.

cond-mat.str-el↗

arXiv2022

Field-induced quantum critical point in the new itinerant antiferromagnet Ti$_3$Cu$_4$

New phases of matter emerge at the edge of magnetic instabilities. In local moment systems, such as heavy fermions, the magnetism can be destabilized by pressure, chemical doping, and, rarely, by magnetic field, towards a zero-temperature transition at a quantum critical point (QCP). Even more rare are instances of QCPs induced by pressure or doping in itinerant moment systems, with no known examples of analogous field-induced \textit{T} = 0 transitions. Here we report the discovery of a new itinerant antiferromagnet with no magnetic constituents, in single crystals of Ti$_3$Cu$_4$ with $T_N$ = 11.3 K. Band structure calculations point to an orbital-selective, spin density wave ground state, a consequence of the square net structural motif in Ti$_3$Cu$_4$. A small magnetic field, $H_C$ = 4.87 T, suppresses the long-range order via a continuous second-order transition, resulting in a field-induced QCP. The magnetic Grüneisen ratio diverges as $H \rightarrow H_C$ and $T\rightarrow0$, with a sign change at $H_C$ and $T^{-1}$ scaling at $H~=~H_C$, providing evidence from thermodynamic measurements for quantum criticality for $H \parallel c$. Non-Fermi liquid (NFL) to Fermi liquid (FL) crossover is observed close to the QCP, as revealed by the power law behavior of the electrical resistivity.

cond-mat.str-el↗

arXiv2020

U-carbon: metallic and magnetic

We report the discovery of a pristine crystalline 3D carbon that is magnetic, electrically conductive and stable under ambient conditions. This carbon material, which has remained elusive for decades, is synthesized by using the chemical vapor deposition (CVD) technique with a particular organic molecular precursor 3,3-dimethyl-1-butene (C6H12). An exhaustive computational search of the potential energy surface reveals its unique sp2-sp3 hybrid bonding topology. Synergistic studies involving a large number of experimental techniques and multi-scale first-principles calculations reveal the origin of its novel properties due to the special arrangement of sp2 carbon atoms in lattice. The discovery of this U-carbon, named such because of its unusual structure and properties, can open a new chapter in carbon science.

cond-mat.mtrl-sci↗

arXiv2019

Effect of synthesis conditions on the electrical resistivity of TiSe$_2$

Dilute impurities and growth conditions can drastically affect the transport properties of TiSe$_2$, especially below the charge density wave transition. In this paper, we discuss the effects of cooling rate, annealing time and annealing temperature on the transport properties of TiSe$_2$: slow cooling of polycrystalline TiSe$_2$ post-synthesis drastically increases the low temperature resistivity, which is in contrast to the metallic behavior of single-crystalline TiSe$_2$ due to charge doping from the residual iodine transport agent. A logarithmic increase of resistivity upon cooling and negative magnetoresistance with a sharp cusp around zero field are observed for the first time for the polycrystalline TiSe$_2$ samples, pointing to weak-localization effects due to low dimensionality. Annealing at low temperatures has a similar, but less drastic effect. Furthermore, rapid quenching of the polycrystalline samples from high temperatures freezes in disorder, leading to a decrease in the low temperature resistivity.

cond-mat.str-el↗