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Thursday 3 September

Materials Science

Exciton multipolarity controls coherent and squeezed phonons in van der Waals heterostructures

Photoexcitation-driven changes in the electronic distribution displace atoms, generating coherent phonons on ultrafast timescales. Two-dimensional (2D) materials and their heterostructures offer a powerful platform for engineering these phonons. Yet, despite the widespread observation of photoexcited coherent phonons, a design principle for controlling their character remains elusive. Here, using detailed atomistic simulations of multilayers of alternating MoSe$_2$ and WSe$_2$, we reveal exciton multipolarity as a design principle for tuning photoinduced phonons from coherent to squeezed. These phonons are interlayer breathing modes, with dipolar excitons coupling linearly to generate coherent states and quadrupolar excitons coupling quadratically to produce squeezed states. Moreover, an out-of-plane electric field enables switch-like control, converting quadrupolar excitons into dipolar excitons and switching the phonon state from squeezed to coherent. For example, in trilayer WSe$_2$/MoSe$_2$/WSe$_2$, the photoexcited 1.04-THz breathing mode switches from a squeezed state at zero field to a coherent state under an applied vertical field. Experimentally, these phonon states can be directly probed by ultrafast X-ray or electron diffraction and indirectly through transient reflectivity. Our results open new avenues for ultrafast control of lattice and electronic dynamics on picosecond timescales, with implications for THz quantum phononics, nanophotonic technologies, and quantum-noise-limited sensing.
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All authors Indrajit Maity, Arash A. Mostofi, Johannes Lischner, Ángel Rubio

Soft Condensed Matter

Simultaneous measurements of enzyme propagation and biopolymer mobility elucidate the directional degradation of a dense biopolymer matrix

Enzymatic degradation of biopolymers underpins critical processes in biotechnological applications and natural processes, such as food digestion and cancer development, yet the interplay between enzyme propagation in a dense substrate and substrate degradation remains unresolved. It remains especially unclear whether degradation of a dense matrix facilitates or impedes enzyme propagation. We simultaneously track with spatiotemporal resolution unidirectional enzyme diffusion and biopolymer degradation in a model system. We demonstrate that enzyme diffusion is decoupled from catalytic activity, while the degradation front progression is dictated by enzyme diffusion, reaction kinetics and slow enzyme deactivation. These findings establish a quantitative framework to optimize enzymatic processes for applications in biomedicine, biomass valorization, and nanotechnology.
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All authors Vincenzo Ruzzi, Antoine Bouchoux, Carole Antoine-Assor, Donna-Joe Bigot, Salma Menzeh, Maike Petermann, Laurent Leclercq, Hervé Cottet, Cédric Montanier, Claire Dumon, Luca Cipelletti, Laurence Ramos

Mathematical Physics · Cross-listed from math.SP

Spectral properties of the magnetic Robin Laplacian on curvilinear half-plane

We analyse magnetic Robin Laplacian in curvilinear half-plane with a smooth boundary. It is well known that the spectrum of the Robin Laplacian is unstable with respect to boundary deformations. This means that if the boundary is a straight line then the spectrum of the Robin Laplacian is purely essential. From the other hand, the perturbation of the boundary produces eigenvalues below the essential spectrum. In this paper, the Robin-Laplace operator with a compactly supported magnetic field is considered. We prove that the spectrum of the magnetic Robin Laplacian is stable under small and local deformations of the boundary.
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Physics and Society

ESRIcascade.jl: A Julia package for fast computation of the Economic Systemic Risk Index

This work presents ESRIcascade.jl, a Julia package for computing the Economic Systemic Risk Index (ESRI). The package combines computational efficiency with a documented interface designed for research workflows. Our benchmarks show that ESRIcascade.jl is from 140 to 300 times faster than existing implementations. For a realistically sized synthetic economy, this reduces computational time from 16 hours to 7 minutes. By reducing computation times, ESRIcascade.jl makes repeated analyses of larger production networks practical and feasible and may enable broader use of ESRI in empirical and methodological research. The package and its documentation are freely available at https://github.com/Devetak/ESRIcascade.jl under the MIT License.
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Instrumentation and Methods for Astrophysics

Morphology of Radio Sources in Representation Space

Understanding radio source morphologies and their classification remains challenging. We previously developed a deep clustering method based on self-supervised learning to classify a subsample of radio sources from the LOFAR Two-meter Sky Survey DR2. This yielded a labelled subset used to fine-tune an ensemble of classifiers. We aim to identify rare morphological classes in a subsample of LoTSS-DR3, which contains > 13 million sources, beyond the 12 classes previously recognised in the DR2 sample. We further aim to characterise the resulting class distribution. We applied the classifier ensemble to derive class probabilities and representations for our samples. Among DR3 sources with low class probabilities, we searched for new clusters in representation space. Moreover, we use these clusters as centroids to classify the low-probability subset. We found that 88% of the sources fall into clearly separated clusters in representation space, coinciding with the DR2 clusters. Within the remaining sources, we identified representatives of six additional morphological classes, including rare morphologies like winged and FR-ambiguous sources. The number of sources in the resulting 18 classes exhibit a strongly skewed distribution, with four dominant classes constituting 69% of the DR3 sample, while rare morphologies account for only a small fraction. The identification of additional morphological classes shows the possibility of open-set recognition with representation learning in an unexplored dataset. Unlike anomaly detection, which flags individual sources as uncommon, this approach identifies representatives of novel morphological classes, providing a framework for discovering novel source populations. The highly skewed class distribution poses a fundamental challenge for constructing balanced training datasets and highlights the need for open-set approaches in future observations.
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Quantum Physics

Quantisation of Abstract Data Types

In this paper, we introduce a notion of abstract quantum data type within the framework of universal algebra. This notion provides an algebraic foundation for describing data abstraction in quantum programming. We formally define a quantisation of classical data types and show that their equational specifications can be soundly lifted to the quantum setting. Two standard quantisation methods for classical functions, namely the bit oracle and the phase oracle, arise as special cases of this general construction. We illustrate the framework with applications to quantum arrays and quantum error-correcting codes, showing how they can be understood through the lens of data-type quantisation. We further establish conditions under which quantisation preserves structural relationships and constructions of classical data types, including embeddings, isomorphisms, and products.
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Materials Science

Heesch Nodal Lines in Inadmissible Achiral Antiferromagnets

Recently, a new class of Weyl semimetals in antiferromagnets named Heesch Weyl semimetals was discovered, which have inadmissible chiral magnetic point group symmetries (inadmissible magnetic point groups are incompatible with ferromagnetic order) and distinctive surface Fermi arcs. In Heesch Weyl semimetals, the Weyl points are pinned at high symmetry momenta with two-dimensional irreducible corepresentations in the Brillouin zone. As the Weyl points are pinned, the Weyl points with opposite topological charges cannot emerge or be brought together for creation and annihilation as in conventional Weyl semimetals. In this work, we show that when mirror or rotoinversion symmetries are restored so that the point group becomes achiral, long doubly degenerate lines connecting Weyl points with opposite topological charges emerge. We call these lines the Heesch nodal lines (HNLs) and their host materials the Heesch nodal line antiferromagnets. HNLs result in a large number of two-dimensional massless Dirac cones for planes intercepting the HNLs in the Brillouin zone. Moreover, a large subset of the HNL antiferromagnets has the special property that the lowest nonvanishing order of the nonlinear anomalous Hall effect starts with the third order. First-principles calculations on representative collinear and noncollinear antiferromagnets, such as MnTe, CrSb, and Mn$_3$GaN, confirm our predictions on the presence of HNLs. When the inadmissible symmetry is broken by strain, the double degeneracy of the HNLs is lifted and the associated massless Dirac cones are gapped out, providing a route to realizing sizable anomalous Hall effects in antiferromagnetic crystals. We conclude that all inadmissible antiferromagnets without parity-time symmetry are topological. They are either Heesch Weyl antiferromagnets or Heesch nodal line antiferromagnets.
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All authors Xing-Yao Guo, Chung-Yuen Chan, Zi-Ting Sun, Kam Tuen Law

Accelerator Physics

Effects of the Direct Space Charge on Transverse Coupled-Bunch Instabilities

The ultralow transverse emittance of diffraction-limited electron storage rings leads to high beam densities, making direct space-charge effects increasingly relevant despite their relativistic suppression at high energy. In this work, we investigate the impact of direct space charge on transverse coupled-bunch instabilities, using PETRA-IV as a representative example. A Vlasov solver, multi-bunch particle tracking, and analytical calculations in normalized phase space are combined to study the coupled-bunch mode spectrum, the nonlinear incoherent tune spread, and the associated Landau damping. Particle-tracking simulations show that the space-charge-induced tune spread can provide sufficient Landau damping to stabilize higher-order head-tail modes. Landau stability diagrams constructed from the analytical tune spread of a frozen bi-Gaussian beam predict the stabilization of these higher-order modes, in agreement with the tracking simulations. These results demonstrate the important role of direct space charge in transverse coupled-bunch dynamics. The analysis framework developed here can also be extended to collective-instability studies in both electron and hadron accelerators.
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Quantum Physics

Metricity of separable quantum optimal transport with the Hilbert-Schmidt cost

We prove that the square root of the separable quantum optimal transport cost associated with the orthogonal projection onto the antisymmetric subspace defines a genuine distance between density matrices. Equivalently, this establishes the triangle inequality for the order-two Beatty-França quantum optimal transport construction induced by the Hilbert-Schmidt distance between pure states. The result also proves metricity of the corresponding distance derived from separable SWAP fidelity. The proof replaces the unavailable gluing argument by convex-roof duality and a dimension-independent interpolation result for Hermitian operators.
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Computational Physics

Computing high-order mixed derivatives in physics-informed neural networks using multi-index Bell polynomials

Physics-informed neural networks for high-order partial differential equations require mixed input derivatives and their gradients with respect to the network parameters. Standard implementations obtain an order-$K$ derivative by repeated automatic differentiation. We instead organize the forward recursion of the multivariate Faà di Bruno formula and its explicit backpropagation over a prescribed downward-closed set of multi-indices, with the Bell-polynomial convolutions tabulated once. The forward pass carries only the derivatives the differential operator requires. The backward pass propagates gradients from losses formed from any subset of them, including nonlinear products and coupled fields. Both recursions are exact up to roundoff and avoid nested computational graphs. An independent Taylor-jet implementation, symbolic checks of the test problems, and finite differences verify derivatives and loss gradients through order seven. On one CPU core, the method evaluates 330 mixed derivatives with respect to four inputs through order seven and the corresponding loss gradient without the memory failures observed for several nested implementations. Numerical tests include third-, fifth-, and seventh-order dispersive equations, incompressible flow, and a manufactured five-field electrohydrodynamic system. The seventh-order Zakharov-Kuznetsov test in $3+1$ dimensions has a relative solution error of $6\times10^{-4}$.
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Strongly Correlated Electrons

Ground-State Phase Diagram, Higher-Winding Topology, and Lifshitz Criticality in an Anisotropic Four-Spin XX Chain

We investigate the quantum critical and topological properties of a spin-$1/2$ XX chain with anisotropic four-spin cluster interactions in a transverse magnetic field. The interplay of exchange anisotropy, cluster interactions, and the external field produces a rich phase diagram with multiple gapped topological phases and distinct quantum critical boundaries. We identify several Lifshitz-type transitions arising from reconstructions of the low-energy Fermi-point structure, including an unconventional multicritical point where distinct critical branches intersect and the momentum-space topology undergoes a singular reorganization. In the isotropic limit, a conventional Lifshitz transition emerges through the merging and annihilation of Fermi points, revealing distinct mechanisms of Fermi-point reconstruction within the same model. The gapped phases are characterized by quantized winding numbers $\nu=0,\pm1,-2,$ and $\pm3$, with the higher-winding phases induced by the extended cluster interactions. The $\nu=\pm3$ phases exhibit a richer topological structure than conventional short-range Kitaev-type chains and are separated from other sectors by field- and interaction-driven gap closings. These topological distinctions are further reflected in characteristic degeneracy patterns of the lowest levels of the bulk entanglement spectrum. Our results demonstrate that anisotropic multispin interactions provide a versatile route to realizing higher-winding topological phases and unconventional multicriticality in one-dimensional quantum systems.
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Mesoscale and Nanoscale Physics

Coherent interaction of WS$_2$ and quasi-2D perovskite excitons over micrometer distances via a cavity field

The coherent coupling of cavity-confined photons and excitonic matter resonances leads to the formation of cavity polaritons, hybrid light-matter quasi-particles. If multiple exciton resonances couple to the same photonic mode, the resulting polariton constitutes a coherent interaction between matter resonances that can be spatially separated without any direct electronic coupling. In this work, we demonstrate the formation of such a coherent coupling at room temperature using an open optical cavity containing two distinct van der Waals materials - monolayer WS2 and layered quasi-2D halide perovskites (HaPs) - separated by $1.5 \mu\rm m$. The system forms three polariton branches, with the middle branch possessing nearly equal fractions of both excitons and the photonic mode. White-light reflectivity and luminescence measurements are in good agreement with simulations using a coupled harmonic oscillator and a microscopic Wannier-Hopfield framework. Our results lay the foundation to combine highly complementary degrees of freedom in 2D materials in an in-situ tunable fashion to enable new polaritonic functionalities.
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All authors Marti Struve, Hamid Pashaei Adl, Jamie M. Fitzgerald, Oliwia Janikowska, Maciej Śmiertka, Alessandro Surrente, Sven Stephan, Christoph Lienau, Falk Eilenberger, Zdeněk Sofer, Watcharaphol Paritmongkol, William A. Tisdale, Paulina Plochocka, Ermin Malic, Christian Schneider, Martin Esmann

Optics

3D scattered light imaging: extracting 3D fiber orientations from 1D line profiles in brain imaging

Understanding the 3D fiber architecture of the brain at the microscopic scale is essential for revealing its structural connectivity and function. Polarization-based optical imaging (3D-PLI) techniques enable high-fidelity reconstruction of single nerve fiber orientations but struggle to resolve fiber crossings, which are critical for recovering the full connectome. Scattering-based imaging provides access to the structure factor of three-dimensionally oriented fibers. By probing a fixed scattering angle under multiple azimuthal illumination angles, in-plane fiber orientations and crossings can be recovered using computational scattered light imaging (SLI). However, despite containing 3D information, a theoretical framework to extract full 3D orientations has been lacking. In this talk, a simple analogical approximation of Rayleigh-Gans scattering theory is introduced to extract the 3D orientation of nerve fibers from one-dimensional SLI measurements. The theory is validated using tilted microscopic glass phantoms consisting of 2 um-thick rod lattices fabricated by two-photon lithography. Finally, the method is applied to brain tissue samples and compared with 3D-PLI.
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All authors Dennis Scheidt, Charlotte Voß, Cristian Rosero Arias, Santiago Saavedra Castano, Felix Matuschke, Roxana Koojimans, Katrin Amunts, Arturo Susarrey-Arce, Markus Axer

Atmospheric and Oceanic Physics · Cross-listed from cs.LG

From Nowcasting to Forecasting: Adapting a Reanalysis-Trained

Accurate cloud-cover forecasts are important for temperature prediction, radiation forecasting, and solar-power operations. Short-range forecasting methods can preserve observed cloud placement during the first forecast hours, but their skill decreases when cloud fields evolve through formation, dissipation and deformation. Longer lead times require accounting for atmospheric evolution, but operational numerical weather prediction (NWP) forecasts may not accurately represent the satellite-observed cloud state at initialization. We develop CloudCast v2, a machine-learning model for 12-hour cloud-cover forecasting from observation-based initial conditions. The model is first trained on the Copernicus European Regional Reanalysis (Ridal2024) to learn cloud-evolution dynamics, and is then adapted to satellite-derived cloud fields using conditional flow matching (Lipman2023), a generative method that transforms noise into cloud-cover forecasts conditioned on the observed initial cloud fields and NWP inputs. CloudCast v2 reduces mean absolute error by 10% relative to its predecessor, CloudCast v1 (Partio2025), over the 1-12 h range. It also overtakes CloudCast v1 in fractions skill score, a neighborhood-based measure of spatial agreement, after approximately 3-6 h, depending on the cloudiness category. These results show that observation-initialized machine-learning forecasts can extend beyond the usual 1-3-hour nowcasting range while retaining spatial detail from satellite cloud fields.
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Quantum Physics · Cross-listed from cs.LG

Projected Riemannian Gradient Descent for the Bures-Wasserstein Barycenter: Dimension-Independent Linear Convergence at Unit Step Size

The computation of the Bures-Wasserstein (BW) barycenter of an ensemble of positive definite matrices arises throughout machine learning, optimal transport, and quantum information. Riemannian gradient descent (RGD) at unit step size – the fixed-point iteration used in practice – converges rapidly, yet existing analyses present a dichotomy: unit-step guarantees carry worst-case exponential dependence on the dimension, while dimension-independent guarantees require small step sizes that forfeit the empirical speed. We resolve this dichotomy, not by improving the guarantees for unit-step RGD, but by proposing a Projected RGD algorithm that achieves dimension-independent linear convergence at unit step size. The achieved rate, $(1 - \kappa^{-3/2})$, where $\kappa$ is the condition number of the ensemble, also polynomially improves on the best small-step guarantee ($\kappa^{3/2}$ versus $\kappa^{5/2}$ iteration complexity). The crux is a novel Projection Lemma: clipping the eigenvalues of a positive matrix to an interval $[\alpha, \beta]$ is the closed-form, non-expansive (1-Lipschitz) BW-metric projection onto the set $\{S : \alpha I \leq S \leq \beta I\}$ – a statement which, unlike its known one-sided counterpart, does not follow from convexity. The projection is moreover free: it reuses an eigendecomposition the next iteration must perform in any case, so the projected and unprojected iterations cost the same per step. The same analysis covers the invariant matrix projection problem of Brahmachari et al. (2025), whose fixed-point algorithm we identify as unit-step RGD on a totally geodesic submanifold, thereby extending the dimension-independent guarantee to that setting verbatim.
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Earth and Planetary Astrophysics

Disk survey in the Serpens star-forming region: Environmental effects in nearby star-forming regions

The external environment where protoplanetary disks are embedded regulates disk evolution. External irradiation, which heats and evaporates gas, as well as frequent stellar encounters, which truncate disks, can reduce disk sizes and masses. Disk surveys in nearby star-forming regions with various environments can help us understand how external environments impact disk evolution. The Serpens star-forming region, which is thought to be dense but not highly irradiated by massive stars, is an ideal laboratory to study the dynamical effects on disk properties. We aim to study how dynamical interactions modify disk dust masses by comparing Serpens with other nearby star-forming regions through their disk masses and 3D stellar densities. We survey 321 young stellar objects from Class I to III in Serpens using ALMA at 0.25 arcsec. We measure disk dust masses from millimeter observations under the optically thin assumption and recompute the 3D stellar density using Gaia data. We apply the same method to other nearby star-forming regions for direct comparison with Serpens. The cumulative disk dust mass distribution of Serpens is similar to those of similarly aged nearby star-forming regions, such as Lupus and Taurus. Along with re-assessment of the 3D stellar density, it suggests that Serpens is not likely to have experienced strong tidal truncation capable of producing lower disk dust masses. We also find that the low disk dust mass tension in Ophiuchus and Corona Australis can be resolved when only disks that have been explicitly identified as members of young (1-2 Myr) sub-clusters are considered. Disks without Gaia identifications, especially in Ophiuchus, are spatially clustered in the 2D projected sky plane and less massive than nearby disks with Gaia identifications, possibly tracing the effects of tidal truncation in denser environments at earlier evolutionary stages.
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All authors Simin Tong, Nienke van der Marel, Jonathan P. Williams, Alexa R. Anderson

Materials Science

Ion-Engineered Insulator-to-Semiconductor Transition in Natural 2D Biotite

Naturally occurring layered silicates offer an abundant yet unexplored class of 2D materials, but their insulating nature limits their functional utility. Here, we demonstrate a chemical strategy that transforms liquid-phase-exfoliated biotite nanosheets into a tunable 2D semiconductor through controlled NaOH treatment. The resulting insulator-to-semiconductor transition originates from Na incorporation, defect generation, and local structural reconstruction while largely preserving the layered framework. Structural and chemical analyses reveal lattice distortion, interlayer reorganization, hydroxylation, and partial Na+-K+ exchange, establishing the origin of the electronic restructuring. This transformation broadens the optical response, shifting the approximately 221 nm absorption toward approximately 280 and 975 nm, reducing the optical bandgap from approximately 5.2 to 3.2-3.5 eV, and introducing low-energy transitions at approximately 1.12-1.17 eV. Electrical measurements reveal nonlinear transport with currents reaching close to 10 microA, demonstrating activated carrier conduction. Ultrafast transient absorption reveals pronounced excited-state absorption, with carrier cooling (0.16-0.38 ps) followed by fast (35-60 ps) and long-lived (336-491 ps) relaxation associated with trap-mediated recombination. Fluence-dependent dynamics reveal a hot-phonon bottleneck at elevated carrier densities. Together with density functional theory calculations, these results establish chemical defect and ion engineering as a powerful route for converting naturally abundant layered minerals into electronically tunable 2D materials for emerging optoelectronic and ultrafast photonic technologies.
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All authors Dipanwita Mitra, Raphael B. de Oliveira, Guilherme S. L. Fabris, Debkanta Ghosh, AyonJyoti Karmakar, Raphael M. Tromer, Marcelo L. Pereira Junior, Douglas S. Galvão, Chandra Sekhar Tiwary, Prasanta Kumar Datta

Mesoscale and Nanoscale Physics

Real-space Floquet topology written by the orbital angular momentum of light

Floquet engineering usually treats light as a uniform control field that changes the topology of an entire driven material. Here we show that structured light carrying orbital angular momentum (OAM) enables a different regime, in which topology is written directly in real space. For ultrathin topological insulator films, circularly polarized Laguerre–Gaussian beams generate a radial Floquet mass whose sign changes define a topological annulus bounded by two concentric chiral ring modes. The transition is helicity selective: below a thickness-dependent critical frequency, left-circularly polarized light drives mass inversion, whereas right-circularly polarized light increases the gap and leaves the film trivial. Independently, the OAM quantum number shifts and reshapes the annulus without changing the frequency, intensity, or helicity. In the decoupled-surfaces limit, the same mechanism produces a purely Floquet-induced topological mass and a vortex-core zero mode. These results identify photon OAM as a control parameter for nonequilibrium topology and provide a route to programmable topological landscapes in quantum materials.
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Quantum Physics

Thermodynamic Irreversibility from Inaccessible Endogenous Quantum Histories

Microscopic unitary dynamics preserves all fine information, yet an isolated finite system can show a robust thermodynamic window in which the entropy associated with a restricted record rises. We ask why information hidden from the current record usually fails to rebuild a low-entropy macrostate. For a fixed projective record, every finite step separates exactly into the evolution predicted from the record alone and an exact correction carried by unresolved microscopic structure. The record-only contribution starts only at second order in time, so all instantaneous change of the record comes from hidden currents between macrostates. We derive the exact entropy rate, separate entropy-spreading from return-oriented currents, and resolve those currents into energy-gap amplitudes. Transitions with the same gap add coherently, revealing how the Hamiltonian and the microscopic state organize hidden information for return. In interacting mixing dynamics the current power is spread over many frequencies; free and deliberately commensurate controls progressively concentrate it, and the engineered dynamics reconstructs a low-entropy macrostate. An independent distribution-level test separates hidden dynamical activity from finite-step return, and an exact classical measure-preserving counterpart shows which parts of the construction are not uniquely quantum. Within the specified record and observation window, irreversibility is therefore not loss of microscopic information, but the failure of that information to organize currents that restore macroscopic order.
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Mesoscale and Nanoscale Physics

Generalized s-d model for Wannier-Mott excitons in layered magnetic semiconductors

The recent discovery of excitons coupled to the magnetic order, and the consequent strong magneto-optic responses, in some van der Waals magnetic semiconductors has triggered intense activity at the interface of magnetism and semiconductor optics. Here, we present an analytically tractable minimal model that describes magnetic order, electrons, holes, and excitons within a unified framework, thereby capturing a wide range of phenomena. It treats the magnetic order and itinerant carriers to be comprised by distinct electronic orbitals that are mutually coupled via orbital-dependent onsite exchange, similar to the treatment of metallic magnets using an s-d model. Investigating CrSBr bilayer as a case study, we benchmark our model and its predictions against recent experimental and ab-initio results finding good agreement as well as new insights enabled by the model's simplicity. Examining the optical selection rules, we find the conservation of a quantum number formed from a combination of spin and layer pseudospin to be a useful guiding principle, even in noncollinear magnetic configurations. Our analysis finds a series of bright and dark excitonic states in such layered A-type antiferromagnets. The presented framework should be valuable in achieving intuitive understanding of recently discovered excitonic phenomena and guiding the discovery of other excitonic states in layered magnetic semiconductors.
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Quantum Physics

Analog quantum simulation of bosonic and anyonic models with flux-driven transmons

When quantum particles interact, many-body phenomena that are hard to simulate classically emerge. Quantum analog simulation offers an alternative in which the target system's dynamics is directly realized in controllable quantum hardware. Here, we give a general protocol for simulating the Bose-Hubbard and anyon-Hubbard models using lattices of capacitively coupled flux-tunable transmons. By modulating the transmon frequencies in an alternating pattern, we resonantly drive multiple many-body transitions and can tune the on-site interaction and density-dependent hopping amplitudes for up to three bosons per site, with no additional restriction on the total particle number. By adding phases to the modulation, which renders the transition amplitudes complex-valued, we propose the first simulation protocol for the anyon-Hubbard model with transmons. Numerical simulations of the driven transmon arrays with experimentally realistic parameters reproduce the characteristic dynamics of the target models across a range of interaction strengths and statistical phases, including the interaction-dependent localization and the statistics-dependent asymmetry of the anyonic quantum walk.
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All authors Isak Lyngfelt, Jorge Fernández-Pendás, Göran Johansson, Laura Garciá-Álvarez

General Relativity and Quantum Cosmology

Not All Resonances Are Created Equal: Prioritizing Tidal Resonances in EMRIs

Tidal perturbations from nearby compact objects can drive resonant "kicks" in extreme-mass-ratio inspirals (EMRIs), imprinting potentially detectable phase shifts in LISA-band gravitational waveforms. We provide a systematic survey of these tidal resonances across EMRI parameter space in the weak-tide, three-body hierarchy, treating the perturber as stationary on the resonance timescale. For generic Kerr orbits we compute (i) resonance contours in $(p,e,x)$ that locate where each $(n,k,m)$ resonance is encountered, (ii) the associated resonance duration, and (iii) the jump amplitudes in the angular momentum $L_z$ and the Carter constant $Q$ (with $\Delta E$ vanishing by time-translation symmetry in the stationary model). Combining jump amplitudes with resonance durations, we construct a practical ranking of the resonances most relevant for waveform modeling, while emphasizing that even modest resonances may still be important through their influence on the phase at which subsequent resonances are entered. All contour and jump data are publicly available.
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All authors Béatrice Bonga, Patrick Bourg, Bram ten Brink, H.A. Peters

Materials Science

Multimodal and Multiscale Interrogation of a Mechanically Tough Glass Forming Copper-Based Metal-Organic Framework

A copper-based metal-organic framework, Cu(Im)2, was synthesized using a sol-gel process and subsequently melt-quenched into glass upon heating above 240 {\deg}C. In this paper, we present a multimodal, multiscale interrogation of the MOF nanocrystals and the resulting glasses. Structural characterization using X-ray diffraction, atomic force microscopy, and electron microscopy was performed to understand the morphology and size of the synthesized nanocrystals and glasses. Thermogravimetric analysis and differential scanning calorimetry were employed to understand the melting process of the crystals to form the glass. Synchrotron pair distribution function analysis was performed to verify that the framework structure is maintained upon melting, and nearfield infrared nanospectroscopy provided insight into the local chemical structure of the materials. The mechanical characterization via nanoindentation revealed that the resulting glasses exhibit an appreciably high elastic modulus (~10 GPa) and the highest fracture toughness (K_1c ~ 0.5 MPa m^1/2) yet reported for MOF glasses. This development is central to the emerging field of MOF-based materials processing and shaping, while upholding mechanical robustness and resistance to cracking.
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All authors Mounir El Skafi, Guo-Qiang Li, Sophie R. Thomas, James D. Taylor, Mark Frogley, Gianfelice Cinque, Marc Pignitter, Michael Reithofer, Jia-Min Chin, Sebastian Henke, Jin-Chong Tan

Computational Physics · Cross-listed from cs.CE

What Do CAE Simulation Agents Really Need Beyond a Generic Harness?

Computer-aided engineering (CAE) simulation is among the largest and most demanding areas of engineering, where setting up a solver such as OpenFOAM, FEniCS, or COMSOL takes real expertise. Large language model (LLM) agents promise to turn a natural-language request into a working simulation, and recent CAE agents add simulation-specific machinery: multi-agent decomposition, domain retrieval, and scripted reflection. That machinery suited weak base models; modern harnesses already supply multi-turn reasoning, tool use, and execution feedback. We ask what a CAE simulation agent still needs beyond a generic harness. With information access and repair budget held fixed, a single-agent harness matches or beats multi-agent specialized systems (FoamBench 96.4% vs.\ 88.2%). Ablations trace this to capabilities the harness already provides: execution-feedback repair lifts FoamBench from 71.8% with no repair round to 96.4%, while scripted reflection adds nothing. The one input that still helps is domain knowledge supplied as solver tutorials, our largest measured gain (80.9% to 96.4%).
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Materials Science

Gd-4f Exchange Splitting and Mo-4d Crystal-Field Redistribution in Gd/W Co-doped La2Mo2O9: A DFT+U Study

La2Mo2O9 (LAMOX) is a promising oxide-ion conductor for intermediate-temperature solid oxide fuel cells, but its practical application is limited by a first-order monoclinic-to-cubic (alpha to beta) phase transition. Here, we investigate the electronic structure of pristine La2Mo2O9 and the Gd/W co-doped composition La1.6Gd0.4Mo1.7W0.3O9 using spin-polarized density functional theory with an on-site Hubbard correction for the localized Gd-4f states. The projected density of states reveals that pristine La2Mo2O9 is an O-2p/Mo-4d charge-transfer oxide in which La contributes negligibly near the band edges. Gd/W co-doping introduces a strongly exchange-split Gd-4f manifold with a majority-minority separation of approximately 1011 eV, substantially redistributes the Mo-4d electronic states through a threefold increase in crystal-field splitting, and reduces the O-2p contribution near the valence-band maximum from 78% to 66%. These electronic signatures are consistent with the experimentally observed lattice contraction, MoO Raman-mode softening, and the non-monotonic evolution of oxide-ion conductivity across the co-doped series. In particular, the pronounced crystal-field splitting and localized Gd magnetism at the highest doping level provide a microscopic electronic explanation for the observed suppression of ionic conductivity. The present results establish an atomistic electronic-structure framework for understanding dopant-induced phase stabilization and oxide- ion transport in Gd/W co-doped LAMOX electrolytes, providing design principles for improved solid oxide fuel cell materials.
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High Energy Astrophysical Phenomena

The Physics of the Nebular Phase in Black Hole X-ray Binaries: Modelling V404 Cygni

Some of the most extreme galactic black hole transients exhibit a nebular phase at the end of their outbursts. This stage was first identified in the 2015 outburst of V404 Cygni, when it dominated the optical spectrum for ~4 days. It is characterised by exceptionally strong optical emission lines, together with a significant increase in the Balmer decrement. The emission features show broad wings reaching velocities consistent with outflow speeds derived from prominent P-Cygni profiles that preceded the nebular phase. They are thus interpreted as arising from previously launched ejecta that expand and recombine as X-ray irradiation declines. In this work, we modelled this phase using the photoionisation code Cloudy. Adopting simple assumptions for the irradiating continuum and emitting gas, we quantitatively reproduced key observables, such as the Balmer decrement and the H$\alpha$ equivalent width, and qualitatively reproduced the observed spectra. Our simulations show that the Balmer decrement remains roughly stable within the observed range across orders-of-magnitude changes in the density and ionisation parameter, spanning $n_\mathrm{H} \sim 10^{10.5}-10^{12.5}\,\text{cm}^{-3}$ and $-1.5 \lesssim \log\xi \lesssim 1$. This supports the scenario in which the nebular phase can persist through moderate ejecta expansion and cooling, consistent with observations. Finally, we used different approaches to constrain the general properties of the nebular phase, which we propose is produced by clumpy, partially ionised ejecta whose total mass likely exceeds the mass accreted during the outburst.
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All authors A. Ambrifi, T. Muñoz-Darias, J. A. Fernández-Ontiveros, J. Casares, D. Mata Sánchez, J. H. Matthews

Solar and Stellar Astrophysics

New scaling relations from MESA models for mass and radius of subgiant stars: application to Kepler targets

The precise determination of the fundamental parameters of stars is crucial for understanding stellar structure and evolution. In this regard, the asteroseismic parameters of solar-like oscillating stars obtained from space telescopes are very useful for determining the mass ($M$) and radius ($R$) of single stars using classical scaling relations. These relations still need to be improved. In this study, we develop alternative scaling relations based on reference frequencies ($\nu_{\rm min}$) due to helium ionization zone glitches, specifically for subgiant (SG) stars. We compile main-sequence and SG {\small{MESA}} models from the literature and derive new scaling relations for stellar $R$ and surface gravity ($g$) of evolved stars. The expressions for $R$ and $g$ are obtained simultaneously as functions of the large frequency separation, $\nu_{\rm min}$, and metallicity. These new relations allow $M$ and $R$ to be reliably determined only from observational parameters, without the need for detailed stellar modelling. The resulting $\nu_{\rm min}$-based relations are applied to a sample of 31 SG stars observed by the Kepler mission, with masses in the range 0.85-1.74 M$_\odot$ and radii between 1.03 and 2.82 R$_\odot$. Using simultaneous solutions, we estimate new mass and radius ranges of 0.89-1.62 M$_\odot$ and 1.04-2.95 R$_\odot$, respectively. The results demonstrate significant improvements in the determination of $M$ and $R$ for evolved Kepler target stars, highlighting the potential of the new scaling relations in asteroseismic analyses.
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Solar and Stellar Astrophysics

The Role of Preceding CMEs and SIRs in Enhancing Shock Acceleration of Electrons

The role of large-scale pre-existing interplanetary structures, including preceding coronal mass ejections (CMEs) and stream interaction regions (SIRs), in shaping the shock acceleration environment for energetic electrons remains not fully understood. In this study, we investigate nine interplanetary shocks observed by the Solar Terrestrial Relations Observatory (STEREO) that are associated with significant MeV electron enhancements, as such enhancements are rarely observed at interplanetary shocks. We combine remote-sensing observations, drag-based modeling, and in-situ measurements to analyze the shock propagation through pre-existing interplanetary structures. Eight of the nine events are associated with a preceding slow or intermediate-speed CME, while six shocks are in-situ observed propagating within preceding ICMEs, indicating that large-scale upstream trapping structures are a common feature of these events. Further analysis identifies three distinct scenarios associated with enhanced electron acceleration: shocks propagating through preceding ICMEs, shock-SIR interactions, and direct injection of flare-accelerated electrons into SIRs. As a representative shock-in-ICME event, the 2012 January 29 low-$\beta$, quasi-perpendicular shock ($\theta_{Bn}\sim87^\circ$) is further investigated using observations together with one-dimensional Monte Carlo test-particle simulations of a shock propagating into a large-scale upstream magnetic loop. The simulation suggests that the upstream loop prolongs electron residence near the shock and substantially enhances acceleration efficiency. These results demonstrate that large-scale interplanetary structures can precondition the upstream magnetic environment, providing favorable conditions for prolonged electron residence and efficient shock acceleration.
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All authors Xiaomin Chen, Seve Nyberg, Rami Vainio, Immanuel Christopher Jebaraj, Chuan Li, Nina Dresing

Strongly Correlated Electrons

Fermi-Point Topology Determines Emergent Conformal Criticality in Extended Quantum Spin Chains

Quantum criticality in one-dimensional quantum systems is characterized by emergent conformal field theories (CFTs), whose central charge counts independent gapless degrees of freedom. Establishing a microscopic connection between this universal conformal structure and the momentum-space topology of the underlying quasiparticle spectrum remains challenging. Here, we uncover a direct correspondence between Fermi-point topology, conformal criticality, and quantum entanglement in an extended quantum spin chain with competing cluster interactions, exchange anisotropy, and a transverse magnetic field. We show that interaction- and field-driven Lifshitz transitions generate conformal critical phases with effective central charges $c_{\rm eff}=1/2$, $1$, $3/2$, $2$, and $3$, including a multicritical point where Ising and Luttinger-liquid sectors coexist. Importantly, the central charge is not determined simply by the number of lattice gap closings or Fermi points, but by the number and conformal content of independent low-energy continuum sectors after accounting for lattice symmetries, reciprocal-lattice identifications, and mode equivalences. Thus, Lifshitz transitions may leave the conformal anomaly unchanged or modify the central charge depending on whether spectral reconstruction generates new independent continuum sectors. Real- and momentum-space entanglement spectra provide complementary microscopic signatures, revealing both the conformal content and momentum-space organization of critical modes. Our results establish a microscopic framework linking Fermi-point topology to emergent CFTs and show how interaction-driven spectral reconstruction can generate higher-central-charge criticality and unconventional multicritical behavior.
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Quantum Physics

Q-Edge: Symmetry-Reduced Quantum Simulation of Structured Extreme Dependence

High-dimensional simulation of multivariate extremes is fundamentally limited by the combinatorial complexity of dependence, often more than by the scarcity of extreme observations. We show that symmetry admits a lossless orbit-space representation that preserves structured extreme dependence while replacing an exponentially large dependence space with a compact set of symmetry classes. Based on this principle, we develop Q-Edge (Quantum Extreme Dependence Engine), a symmetry-reduced quantum framework that operates directly in orbit space, enabling scalable simulation and digital twins of structured extreme systems. By transferring symmetry into the data representation rather than the quantum circuit, Q-Edge allows unconstrained quantum generative models to exploit dramatically reduced state spaces. For a 30-dimensional problem, approximately 1.6 million angular states collapse to 256 orbit states, reducing the required quantum representation from about 21 qubits to 8. Our results establish a general computational principle for scalable quantum simulation of structured extreme dependence.
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All authors Hongrui Zhang, Paolo Recchia, Jianlong Lu, Ying Chen