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Physics Condensed Matter

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Thursday 18 June

Materials Science

Enhanced electronic correlations and altermagnetic ground state of two-dimensional CsCr3Sb5 monolayers

Recently, layered corrected kagome metal CsCr3Sb5 have garnered significant attention attributed to its flat bands near the Fermi level (EF) and altermagnetic ground state [ Yi Liu et al., Nature 632, 1032 (2024)]. However, the van Hove singularities (vHSs) in bulk CsCr3Sb5 are far away from the EF, while an effective modulation of VHS toward the EF is essential for exploring intriguing electron transport properties. In this work, using first-principles calculations, we investigate electronic structures of two-dimensional (2D) Cr3Sb5 and CsCr3Sb5 monolayers which may be mechanically exfoliated from bulk materials. Notably, it is revealed that both flat bands and vHSs simultaneously reside in close proximity to the EF in Cr3Sb5 monolayer, signifying enhanced electronic correlations. Importantly, a tensile strain further shifts the incipient flat bands and vHSs of two monolayers simultaneously to the vicinity of the EF, suggesting strain tunable electronic correlations and concomitant quantum effects. Furthermore, altermagnetic ground state is also revealed due to retained mirror symmetry between two sublattices in these two monolayers. Thus, this work advances understanding and modulations of electronic properties of 2D CsCr3Sb5 monolayers, strengthening their great potential for exploring unconventional quantum phenomena and altermagnetism.
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All authors Z. H. Guan, Z. L. Peng, W. Z. Zhuo, G. Tian, Z. P. Hou, D. Y. Chen, Z. Fan, X. B. Lu, X. S. Gao, M. H. Qin, J. M. Liu

Statistical Mechanics · Cross-listed from hep-th

Quantum models with the Yang-Lee phase transition

In this article, we present four different $1+1$D quantum models that realize the Yang-Lee (YL) phase transition under a deformation that preserves $PT$ symmetry. These are the antiferromagnetic Ising spin chain in transverse and longitudinal magnetic fields, the massive Schwinger model, the Blume-Capel model, and the three-state quantum clock model. Using the state-operator correspondence, we identify the YL critical point, compute the scaling dimensions of the lowest operators in each model, and find perfect agreement with the exact results for the YL criticality in two dimensions. Using bosonization for the Schwinger model and the Polyakov-Hubbard transformation for the other models, we show that in all of these quantum models the YL critical point is described, as expected, by a massless bosonic field with an $i \phi^3$ interaction. In the quantum clock model, this critical field interacts with a massive bosonic field, and we identify the massless and massive states in the Hamiltonian spectrum. In addition, we numerically compute the two-point function of $\phi$ at the Yang-Lee critical point and show that it grows with distance, in agreement with theoretical expectations.
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Strongly Correlated Electrons · Cross-listed from hep-th

Operational Tube-Sector Theory of Quantum State Distinguishability Under Generalized Symmetries

A variational principle for quantum-state distinguishability is established in many-body systems with generalized symmetries, including noninvertible cases described by fusion categories. Standard fidelity and symmetry-resolved diagnostics emerge as coarse-grained limits of a more refined operational structure. When symmetry actions terminate at entanglement cuts, distinguishability is governed by boundary tube algebras within a symmetry-constrained measurement resource theory. The physically admissible instruments are characterized by complete positivity, entanglement-cut locality, boundary-module covariance, and sequential stability. The resulting optimal measurement structure is uniquely fixed by the center of the boundary tube algebra, $\mathcal{A}_{\mathrm{phys}} = Z\!\left(\mathrm{Tube}_{\mathcal{C}}(\mathcal{M}_A)\right)$, whose primitive dempotents define tube-sector probabilities that refine fidelity-based and symmetry-resolved descriptions. The associated tube positive-operator-valued measures (POVMs) are extremal and yield optimal one-shot hypothesis-testing distinguishability under symmetry constraints. The categorical selection rule is universal across fusion categories and independent of microscopic realization; microscopic models enter by choosing the boundary module and the protocol family used to witness a nontrivial tube fiber.
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Materials Science

HEACalculator: An Open-Source Python Tool for Thermodynamic Property Calculation and Solid Solution Prediction in High-Entropy Alloys

High-entropy alloys (HEAs) have attracted sustained interest since their introduction by Cantor et al. and Yeh et al. because multi-principal-element compositions can exhibit unusual combinations of strength, thermal stability, and functional performance. A recurring problem in HEA design is determining whether a candidate composition is likely to form a single-phase solid solution or instead separate into multiple phases or intermetallic compounds. That question sits early in the alloy-design workflow because it shapes which compositions require further thermodynamic analysis, synthesis, and experimental validation. HEACalculator is an open-source Python package for calculating thermodynamic and structural descriptors used in HEA research and for evaluating published solid-solution formation rules in a single place. It computes sixteen commonly used quantities, including mixing enthalpy, configurational entropy, valence electron concentration, Hume-Rothery electron-to-atom ratio, atomic size mismatch, electronegativity mismatch, and derived stability parameters such as Omega, Lambda, and Phi, and it evaluates eight published prediction criteria. The package combines a curated elemental and binary-interaction dataset with three access modes: a command-line interface (CLI), a desktop graphical user interface (GUI), and a Python application programming interface (API) for programmatic use in notebooks and screening workflows.
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Wednesday 17 June

Statistical Mechanics

A few remarks on hyperstatistics and some applications

In a recent paper [arXiv:2604.24783 (2026)], we have proposed a general approach to treat systems with inherent non-Boltzmann-Gibbsian behaviour. Given the extremely high accuracy of our approach, we have adopted the term hyperstatistics. We have applied such a statistical mechanics approach, i.e., hyperstatistics, to the discharge of a capacitor in a RC series circuit, pumping of $^4$He of a closed cycle cryostat, midrapidity data of $p$-Pb collisions at the LHC, as well as for the distribution of accelerations in turbulent systems. Here, we discuss into more details the ground of hyperstatistics. We demonstrate the versatility of hyperstatistics upon applying it to the velocity autocorrelation function in Brownian motion and also regarding its potential to describe brain dynamics.
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All authors Lucas Squillante, Samuel M. Soares, Guilherme Lepski, Mariano de Souza

Materials Science · Cross-listed from physics.chem-ph

LLM-Guided Test-Time Discovery of Quantum-Chemical Approximation Algorithms

Quantum chemistry simulations underpin modern materials discovery, yet their impact is limited by steep computational cost and dependence on fixed approximation schemes. Foundation models, such as machine-learned interatomic potentials, have accelerated parts of this workflow, but their reliance on large-scale pretraining restricts adaptability at the frontier of chemical space, where methodological innovation and sparse data are the norm. Agentic AI systems can automate existing simulation pipelines, yet they remain constrained by the predefined tools and algorithms they orchestrate. In response, we introduce LADeQ, an LLM-guided workflow that discovers, implements, and benchmarks candidate approximation algorithms at test-time within existing quantum chemistry codes. Rather than selecting from a predefined repertoire, LADeQ constructs candidate approximation schemes on demand, drawing on techniques from disciplines such as spatial statistics, circuit simulation, and kernel methods that have had little prior presence in electronic-structure theory. Because it builds on an out-of-the-box language model, LADeQ requires no task-specific pretraining or curated data, and the resulting implementations are transparent and inspectable, with explicitly traceable approximation errors that enable principled control of accuracy–efficiency trade-offs. We show that LADeQ accelerates coupled cluster singles and doubles (CCSD) and configuration interaction singles and doubles (CISD) calculations while keeping correlation-energy errors within user-specified tolerances, demonstrating autonomous, objective-driven discovery of approximation algorithms inside existing electronic-structure solvers.
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All authors Masaya Hagai, Yuta Suzuki, Tomoya Murata, Shuhei Kurita, Masaki Adachi

Materials Science

Coordination-Sensitive Nanoscale Analysis of Defect-Driven Phase Transformation in Si-Doped (AlXGa1-X)2O3

Defect-driven phase instability critically influences the structural reliability of ultrawide bandgap oxides, yet direct nanoscale metrics linking local chemistry to structural transformation remain limited. Here, we introduce a coordination-sensitive atom probe tomography framework that quantitatively resolves reductions in local cation coordination and links them directly to defect-driven phase transformation. Using Si-doped beta-(AlxGa1-x)2O3 heterostructures with controlled Al composition (6-17%) and doping levels (10^17-10^20 cm^-3), we show that gamma-phase inclusions emerge exclusively under the combined conditions of elevated Al content and heavy Si doping. Two-dimensional compositional mapping reveals pronounced lateral Al/Ga inhomogeneity in these regions, while nearest-neighbor and radial distribution analyses quantitatively resolve a significant reduction in first-shell Ga coordination, consistent with local cation deficiency. Correlative scanning transmission electron microscopy confirms that these coordination-depleted regions coincide spatially with gamma-phase inclusions. Density functional theory further supports this mechanism, demonstrating that Al incorporation reduces monoclinic lattice stability and, in conjunction with donor-induced vacancy formation, facilitates vacancy-mediated cation rearrangement and coordination collapse. Together, these results establish coordination loss as a measurable nanoscale signature directly linked to defect-driven phase instability. This framework provides a generalizable approach for probing defect-driven phase instability in doped and alloyed ultrawide bandgap semiconductors.
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All authors Shaon Das, Jith Sarker, Christopher Chae, Lingyu Meng, Joel B. Varley, Hongping Zhao, Jinwoo Hwang, Baishakhi Mazumder

Materials Science

Charge-state control of carbon-related optical absorption in AlN

Sub-bandgap optical absorption in AlN between 2 eV and 4 eV is widely observed, but its microscopic origin remains contested. Using photo-induced electron paramagnetic resonance (photo-EPR) and optical absorption spectroscopy on the same samples, we demonstrate a correlation between this absorption band and the neutral charge state of substitutional carbon on the nitrogen site (C$_N$). Hybrid functional calculations of the optical absorption spectra show that a transition involving C$_N$ and the valence band occurs near 3.3 eV, which agrees well with a peak identified within the measured optical absorption between 2 eV and 4 eV. This conclusion requires the combined ability to manipulate the charge state of carbon using photo-EPR and to use first-principles calculations of the absorption line shape that account for the dispersion of the valence band and the energy dependence of the optical matrix elements.
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All authors Helen C. Robinson, Daniil Danilin, Md Shafiqul Islam Mollik, Darshana Wickramaratne, John L. Lyons, Vladimir Fedorov, Sergey Mirov, M.E. Zvanut

Strongly Correlated Electrons · Cross-listed from quant-ph

String dynamics of a (2+1)D U(1) quantum link model on a digital quantum computer

The (2+1)D U(1) pure gauge theory always exists in the confining phase, with strings of non-zero string tension giving a characteristic linear potential between static charges. This makes it a useful testing ground for quantum computing methods designed to study string dynamics of confining gauge theories. Here we implement a minimal U(1) quantum link model on a quantum computer with qubit degrees of freedom representing the dual height variables of the model. This facilitates an efficient realization of plaquette interactions and enables effective calculations of real-time dynamics that are inaccessible to traditional quantum Monte Carlo. A specifically tailored lattice geometry is chosen to match the heavy-hexagonal geometry of the IBM quantum hardware used here, minimizing non-adjacent qubit interactions. By performing quantum quenches from a simple initial string state, we probe the transverse quantum fluctuations of the string before it thermalizes. Our experimental results from digital quantum simulations, with up to 112 qubits, show good agreement with reference tensor-network calculations at short times and with thermal averages at long times. Near the phase transition, the quench dynamics exhibit large fluctuations of the initial string that extend across both spatial dimensions of the lattice. Nonetheless, our error-mitigated estimators from the quantum hardware also give accurate predictions in that regime, with noise-induced violations of local gauge symmetries comparable to finite-bond-dimension tensor-network results.
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All authors Anthony Gandon, Alessandro Mariani, Debasish Banerjee, Emilie Huffman, Gurtej Kanwar, Francesco Tacchino, Uwe-Jens Wiese, Ivano Tavernelli

Materials Science

Deposition and Growth of the AlCoCuFeNi High-Entropy Alloy Thin Film: Molecular Dynamics Simulation

The growth of a thin film of a high-entropy AlCoCuFeNi alloy on a silicon (100) substrate was studied using molecular dynamics modeling. The simulation was carried out using the embedded atom model to describe the interactions among Al, Co, Cu, Ni, and Fe atoms. The interaction between Al, Co, Cu, Fe, Ni atoms and the Si substrate was modeled using the Lennard-Jones potential, while the interaction between silicon atoms was described using the Stillinger-Weber potential. The total simulation time was 50 ns. It was found that small clusters were formed at the first stage of deposition and that crystallization started after approximately 5 ns of simulation, when the characteristic cluster size was about 2 nm. At the end of the simulation, after 50 ns of modeling, the simulated film contained face-centered cubic, body-centered cubic, hexagonal close-packed, and amorphous phases. Analysis of the radial distribution function made it possible to determine nearest-neighbor distances and estimate the lattice parameters of these phases.
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Mesoscale and Nanoscale Physics

Optical spin injection in graphane and fluorographene

We theoretically investigate the optical spin-injection response in different stoichiometric configurations of graphane and fluorographene using density functional theory. Our goal is to determine which configuration yields the strongest degree of spin polarization. The results show that the fluorographene zigzag configuration yields the best degree of spin polarization response (${\cal DSP}^{\mathrm{z}}$), with 98% spin polarized electrons at the band edge and over a wide range of excitation photon energies. In contrast, other graphane and fluorographene configurations achieve a ${\cal DSP}^{\mathrm{z}}$ of roughly 83–100%, but only within a limited photon-excitation energy range. In structures with low spin-orbit coupling, the degree of spin polarization is close to 100% over a wide range of photon energies. For higher spin-orbit coupling, this strong response appears, but only in a narrow photon energy region. Additionally, under the band-resolved decomposition scheme, the contributions of different band-to-band transitions to the ${\cal DSP}^{\mathrm{z}}$ spectrum are identified by summing only the selected valence and conduction bands. Our findings show that almost the entire ${\cal DSP}^{\mathrm{z}}$ spectrum of the fluorographene zigzag configuration comes from transitions that involve only the top valence band, which is a mixture of C–p and F–p states.
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All authors Angélica Marina López-Martínez, César Castillo-Quevedo, Cesar Camas-Flores, Analila Luna-Valenzuela, Jose Luis Cabellos

Soft Condensed Matter

Collective phases in overdamped magnetic self-propelled spherocylinders

We study the collective dynamics of self-propelled spherocylinders carrying magnetic dipole moments in two dimensions. Magnetic interactions are modeled as two opposite monopoles $\pm Q$ separated by a distance $\ell$ along the particle director, a dumbbell model that remains well-defined at short range and introduces an explicit geometric lever arm for the magnetic torque. This approach, combined with the elongated particle geometry, produces a torque that competes with steric alignment in a manner inaccessible to point-dipole or disk models. By independently varying monopole separation and dipole strength (parameters that map directly onto the geometry and magnetization of cylindrical magnets) we show that the system navigates a rich landscape of collective states: gas, polar flock, chain, vortex-alignment, and locked-dimer phases. Our results establish that particle elongation and distributed magnetic charge together provide a minimal, experimentally accessible set of tuning knobs for controlling coherent states in magnetic active matter, with direct implications for the design of self-organized magnetic microswimmers and active colloidal assemblies.
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Statistical Mechanics · Cross-listed from physics.comp-ph

sft-wick: A formalism and package for Feynman-diagram expansion and evaluation in stochastic field theories

When stochastic field dynamics are cast into a path-integral formulation, perturbation theory becomes systematic but the resulting expansion quickly grows combinatorially large. The setting targeted here includes fields with several components and several dimensions, matrix propagators, tensor-valued couplings, and non-Gaussian driving noise specified by arbitrary n-point cumulants. Wick pairings grow factorially, and component indices must be routed through the tensor-valued vertices. The useful output is not a raw contraction list, but a diagram table: one entry per topology, with multiplicities, coupling sums, signs, and causal constraints resolved. We present sft-wick, an open-source Python package that constructs these diagram tables and computes their integrals numerically. Given an action and an observable, it enumerates topologically distinct Feynman diagrams, derives their algebraic coefficients, and evaluates the resulting diagram integrals from user-supplied response and cumulant functions. The core algorithm enumerates spatial topologies before routing component indices, avoiding contraction-by-contraction Wick expansion. Response-field constraints, including vanishing response-response contractions, the Ito prescription, and the absence of causal response loops, are enforced during enumeration. Predictions are validated against direct Langevin simulations in two worked examples, with Gaussian and with non-Gaussian driving noise, and agree with the simulations within stated error budgets.
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Materials Science · Cross-listed from math.NA

Moreau-Yosida-based Kohn-Sham Inversion for Periodic Systems

Density-potential inversion for periodic systems within Moreau-Yosida-regularised density-functional theory is investigated, both theoretically and numerically. We develop the framework in a periodic homogeneous Sobolev space and use it to recover the exchange-correlation potential of Kohn-Sham theory through a limiting procedure. A key analytical ingredient is the proof of lower semicontinuity of the non-interacting kinetic-energy functional in the chosen topology. The proximal mapping, together with its algorithmic evaluation, plays a central role in the resulting inversion scheme. Numerical experiments illustrate the performance and properties of the method for both the Kohn-Sham and Gross-Pitaevskii equations.
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All authors Vebjørn H. Bakkestuen, Michael F. Herbst, Vegard Falmår, Markus Penz, Andre Laestadius

Statistical Mechanics

Exact operator dynamics in Lindbladian Wess-Zumino-Witten conformal field theories

Understanding the time evolution of physical observables in open quantum many-body systems coupled to external environments is a natural and difficult problem, and exact results are still rare. In this work, we study this problem for Wess-Zumino-Witten (WZW) conformal field theories with Lindblad jump operators linear in Kac-Moody current modes. We investigate the exact operator dynamics generated by these Lindbladians, identifying classes of current operators whose Heisenberg equations close and can therefore be solved analytically using the underlying current algebra. In Abelian $U(1)_k$ WZW theories, this closure of operator dynamics holds for arbitrary settings of jump rates and includes exactly tractable cooling dynamics. In contrast, for non-Abelian WZW theories, exact closure occurs only for symmetric current-mode dissipation, where upward and downward current-mode transitions occur with equal rates, and even then it leads to a simple closed evolution only for a single current operator. Generic imbalances, including those needed for cooling, produce additional non-Abelian terms and prevent closure of the opeartor dynamics. Consequently, the current algebra gives rise to a broad family of exactly solvable dissipative dynamics in the Abelian setting, whereas in the non-Abelian case it singles out only a special exactly solvable dynamics corresponding to an infinite-temperature bath.
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Quantum Gases

Unleashing Emergent Fermions with Rydberg Atom Simulators

Rydberg atom simulators, in both analog and digital modes, have attracted significant recent interest due to their versatile geometric reconfigurability. In this work, leveraging this feature, we propose two complementary approaches, one for each mode, to characterize emergent fermions in critical quantum many-body systems. In the analog mode, we assemble the Rydberg atoms in a "developable" (namely, preserving local couplings) Möbius band geometry to realize antiperiodic boundary conditions, where fermionic states reside. Spectroscopic measurement in this sector then reveals universal energy ratios of the bosonic and fermionic states. In the digital mode, we carry out a fermionic version of Kibble-Zurek ramping with a quantum circuit, directly addressing the fermionic scaling form. Reconfigurability allows an exponential speed-up of this task, with an $O(\log L\log\log L)$ circuit-depth overhead. Our work establishes the Rydberg atom simulator as a uniquely powerful platform to attack the notoriously difficult issue of experimentally probing emergent fermions that are nonlocally defined in a bosonic system.
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All authors Hanteng Wang, Xingyu Li, Shang Liu, Yingfei Gu, Chengshu Li

Strongly Correlated Electrons

Many-Body Protection of Topological Edge Memory in Strong Interacting Quenches

Quantum quenches drive edge states far from equilibrium, yet whether the memory of a topological initial state survives in a non-integrable, interacting system has remained largely unexplored. We study this question in the bond-alternating XXZ chain—an interacting Su–Schrieffer–Heeger model hosting symmetry-protected topological edge modes with markedly enhanced boundary magnetization—and analyze quenches across all combinations of single-particle and many-body initial and final Hamiltonians. The results organize by a single distinction as we rigorously establish in this work: whether the post-quench Hamiltonian is free or genuinely interacting. For a free post-quench Hamiltonian, the dynamics is solved exactly by a correlation-matrix approach; the boundary-mode return amplitude decays as $t^{-3/2}$, and initial interactions enter only through a dressed one-body density matrix. For a genuinely interacting post-quench Hamiltonian, finite-time stability bounds prove that away from local resonances the first-dimer magnetization remains stable on time windows growing as arbitrarily large powers of the inverse inter-dimer coupling. Matrix product state simulations across all four protocols show that interactions in the final Hamiltonian markedly extend finite-time boundary memory—with local suppression near the isotropic $SU(2)$ point—revealing a many-body protection mechanism in a non-integrable system where scrambling would otherwise wash out initial-state memory fast.
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Disordered Systems and Neural Networks

Observation of complete delocalization in disordered photonic lattices

We present the exceptional phenomenon of complete absence of Anderson localization, and perfect transmission of particles, in a completely disordered diamond-dot chain. We analytically show a proof for the condition to observe this exceptional phenomenon, based on a transparent window emerging from a geometrical condition. We support our theoretical prediction by numerical simulations and direct experimental observation of the transmission probabilities of the light in a femtosecond laser-written diamond-dot photonic lattices. We additionally show that for a $\pi$ effective magnetic flux, extreme localization of the light in the same system may occur, independently on the specific geometry. Our results open up an excellent platform for controlling the transmission of energy from ballistic to zero transmission, in a completely disordered lattice system..
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Statistical Mechanics

Odd fluids from chiral cellular automata

Cellular automata are discrete dynamical systems defined on a lattice, in which each site carries a finite set of states that evolve in time according to local deterministic rules. An important application of cellular automata is in lattice gas models of fluids, where the cellular automaton framework provides a particle-based microscopic description of hydrodynamic behavior. The macroscopic fluid equations emerge after coarse-graining over many lattice sites and time steps, offering a bottom-up route to hydrodynamics. A celebrated example is the Frisch-Hasslacher-Pomeau (FHP) model, an automaton defined on a two-dimensional triangular lattice that yields the two-dimensional Navier-Stokes equations upon coarse-graining. In this work, we construct a parity-breaking generalization of the FHP model through two modifications: introducing chiral two-body collision rules and systematically rotating particle velocities to mimic the effect of a background magnetic field. We show that this automaton yields a hydrodynamic model with odd viscosity, a transverse transport coefficient that is a hallmark of odd fluids. We verify the analytical transport coefficients using Poiseuille-flow simulations of the chiral FHP automaton. Our results demonstrate that the chiral automaton introduced here provides a bridge between microscopic parity-breaking scattering processes and macroscopic odd-fluid hydrodynamics.
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All authors Andrew A. Allocca, Shiva Heidari, Thomas Iadecola, Armin Rahmani, Pouyan Ghaemi, Sriram Ganeshan

Quantum Gases · Cross-listed from quant-ph

Solving Nonequilibrium Dynamics via Influence Matrix Bootstrap: Floquet-PXP Model

Studies of integrable systems have profoundly deepened the fundamental understanding of quantum many-body physics. While equilibrium properties such as ground states and thermodynamics can often be characterized efficiently, accurately characterizing nonequilibrium integrable dynamics remains a significant challenge. Here, we develop an influence matrix bootstrap approach for exactly solving nonequilibrium dynamics. This approach begins with an ansatz consisting of a set of local tensor relations, termed generalized zipper conditions, and uses finite-time data to construct exact solutions of local dynamics that extend to arbitrarily long times. We demonstrate this approach in the "Rule 201" quantum cellular automaton, an integrable Trotterization of the PXP Hamiltonian. This uncovers a rich landscape of nonequilibrium behavior exhibiting initial-state dependence. As an example, we investigate the fate of persistent oscillating dynamics under local non-integrable perturbations, and present analytical results for non-thermal relaxation constrained by conservation laws. We also obtain numerically exact results for entanglement growth across a broad class of initial states. Furthermore, from an information-theoretic perspective, we identify a refined structure of multitime correlations termed the hidden Markov orde}: the memory encoded in the dynamics separates into finite-length and long-range distributed components, which becomes transparent in an exact split-index matrix-product-state representation of the influence matrix. Our approach enables unified investigations of nonthermalizing and thermalizing regimes of nonequilibrium dynamics within a single analytically tractable model, and can be tested experimentally in state-of-the-art quantum simulators such as Rydberg atom arrays.
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Strongly Correlated Electrons

Three-dimensional Foliated Fractional Quantum Hall Phases

Foliated topological orders in three dimensions are layered systems in which anyons are free to move within a layer but cannot hop between them. A simple model with such a phase is a stack of decoupled two-dimensional electron gases in a strong magnetic field, each in the same fractional quantum Hall state. By focusing on the case of filling $\nu=1/3$ of the lowest Landau level in each layer, we show that (i) the limit of decoupled Laughlin states is stable upon introducing interlayer interactions and (ii) the system can enter a spontaneously layer-trimerized foliated non-Abelian Fibonacci phase. We support our claims by numerical exact diagonalization of up to 10 layers as well as perturbative analytical calculations. Specifically, we show that the foliated Fibonacci phase exists in the 9-layer system with pseudopotential interactions within and between neighboring layers. We identify the phase via quasihole counting and by calculating the overlap with a model wave function which we derive from the associated conformal field theory. Our numerical results suggest the possibility of realizing these phases in layered van der Waals crystals in strong magnetic fields, as well as in multilayer heterostructures.
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All authors Sahana Das, Navketan Batra, Andrea Kouta Dagnino, Dan Mao, Nicolas Regnault, Glenn Wagner, Titus Neupert

Superconductivity

Electrical magnetochiral anisotropy in Rashba superconductors

We theoretically investigate the role of higher-order Lifshitz invariants in nonreciprocal charge transport in two-dimensional noncentrosymmetric superconductors with Rashba spin-orbit coupling. In the superconducting state, these symmetry-allowed terms give rise to critical-current nonreciprocity, while in the normal state near the superconducting transition they generate a pronounced magnetochiral anisotropy. Using symmetry-constrained group-theoretical methods, we systematically construct the allowed Lifshitz invariants and derive the corresponding vector structure of the nonreciprocal current. To describe nonlinear transport in the fluctuation regime, we apply a generalized time-dependent Ginzburg-Landau theory that incorporates both the Aslamazov-Larkin contribution from fluctuation-induced Cooper pairs and the Maki-Thompson contribution associated with quantum interference in the Cooper channel. We further analyze the effects of disorder scattering and dephasing on the resulting nonreciprocal response.
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Soft Condensed Matter

Sequential replica exchange with solute tempering for atomistic modeling of supramolecular polymer structures

Predicting detailed atomistic structures of self-assembling systems remains a challenge for all-atom molecular dynamics simulations. Replica exchange with solute tempering (REST) has been used to study those systems by accelerating all monomers in a global and uniform manner. While such a global approach can in principle predict any morphology of the system, it has computational drawbacks such as inefficient replica traversal due to order-disorder transitions and the growing number of replicas with system size. To address these issues, here we propose an alternative, stepwise construction approach to modeling supramolecular polymers under the assumption of one-dimensional polymerization. Specifically, we generate polymer structures by adding new monomers one by one to the system and applying REST to the new monomers to find their optimal binding positions based on an energy-based scoring function. The monomer addition and enhanced sampling are repeated sequentially until a polymer of desired length is obtained. We test the above procedure using a model supramolecular polymer in explicit solvent, and show that it can generate a polymer structure with characteristic H-bonding patterns at reduced computational costs, while also improving the efficiency of replica traversal significantly. We thus expect that the sequential REST will be useful for modeling supramolecular polymers, particularly for cases where global REST simulations are too demanding computationally.
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Statistical Mechanics

Spectra as a classical phenomenon, and the Einstein classical program

According to Born (Atomic Physics, page 103), spectra are “quantum phenomena, which from a classical standpoint are perfectly unintelligible”. However we illustrate results on classical calculations of infrared spectra of ionic crystals (actually LiF) which show that the situation is much more complex. Indeed it turns out that: 1) At room temperature and at higher ones (up to 1060 K) the classical computations reproduce the experimental data, even better than the presently available quantum ones do; 2) At lower temperatures (even at 7.5 K), the classical computations reproduce pretty well the data, if one accepts the idea advanced in 1916 by Nernst (the inventor of the third principle) that zero-point energy has room in classical physics too. It is eventually pointed out that the mentioned results might be regarded as a first step towards an implementation of the Einstein Classical Program, which aims at deducing quantum physics (admittedly the correct theory) from a realistic theory. In fact, we are considering the Einstein classical program in the extreme version in which the realistic theory is just (essentially, see below) classical electrodynamics of matter in bulk, involving phase space orbits, solutions of Newton equations. An Appendix is devoted to illustrate the Nernst approach, which concerns also the relation between equipartition and Planck's law.
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Mesoscale and Nanoscale Physics · Cross-listed from quant-ph

Quantum solitons and their quantum walks in transmon arrays

Superconducting qubits are artificial atoms whose spectra and interactions can be engineered through appropriate circuit design, a versatility that can be exploited for quantum simulation. We theoretically investigate a linear array of capacitively coupled transmons, effectively described by a Bose-Hubbard Hamiltonian with attractive interaction. We revisit the discrete-soliton nature of the lowest-energy band of the spectrum, and identify spatially localized quantum solitons. The solitonic character of these states is revealed through their time evolution, which displays a quantum interference pattern, or quantum walk, highlighting their composite nature. We discuss protocols for preparing spatially localized quantum solitons that are compatible with current state-of-the-art tunable-transmon circuits. Our results demonstrate that superconducting circuits provide a promising and experimentally accessible platform for the investigation of quantum soliton physics.
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All authors Ben Blain, Giampiero Marchegiani, Luigi Amico, Gianluigi Catelani

Statistical Mechanics

Topological spectral form factor reveals emergent non-Hermitian single-particle $\mathcal{PT}$ transitions from many-body quantum chaos

In equilibrium, topological defect insertions in quantum and classical partition functions provide non-perturbative probes of phase transitions beyond local observables. In non-equilibrium physics, the spectral form factor provides a minimal probe of universal quantum dynamics and is a product of two partition functions at imaginary inverse temperature. We define the topological spectral form factor (TopSFF) by inserting topological defects acting non-trivially on the doubled partition functions, producing mismatched spacetime world-sheet topologies. For the minimal $\mathbb{Z}_2$ spatially extended defect, implemented by the global swap operator, we derive an exact mapping of the TopSFF of a generic $(1+1)$D many-body chaotic system to an emergent $(3+1)$D non-Hermitian single-particle problem describing a temporal domain wall (tDW). We show analytically that the effective tDW dynamics undergoes a $\mathcal{PT}$ symmetry breaking transition at finite interaction strength $\epsilon_{\mathrm{EP}}$: below $\epsilon_{\mathrm{EP}}$, the leading modes are polarized into Gaussian or non-Gaussian tDW sectors and the TopSFF varies monotonically and exponentially with system size; above $\epsilon_{\mathrm{EP}}$, the tDW sectors hybridize and the TopSFF oscillates with system size; at the exceptional point $\epsilon_{\mathrm{EP}}$, Jordan non-diagonality produces a linear-in-system-size enhancement. For minimal temporally extended topological defects associated with global swap or time translation, we derive exact universal TopSFF free-energy scaling forms. We verify these signatures numerically in independent models.
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Mesoscale and Nanoscale Physics

Exclusion Statistics as a Thermodynamic Resource in Quantum Heat Engines

The maximum power extractable from a quantum thermoelectric heat engine operating with free fermion carriers is bounded by the universal Whitney limit, $P_{\text{fermion}}^{\max} \simeq 0.0321\pi^2 k_B^2(T_L-T_R)^2/h$. We demonstrate that this bound is not fundamental to quantum heat engines but is instead an artifact of fermionic statistics. Within the nonlinear Landauer-Büttiker framework, a bosonic working medium yields a strictly enhanced universal maximum power, $P_{\text{boson}}^{\max} = (\ln 2)^2\, k_B^2(T_L-T_R)^2/h$, exceeding the fermionic limit by a factor of $(\ln 2)^2/(0.0321\pi^2) \approx 1.52$. We propose magnon transport through a ferromagnetic spin chain as an experimentally viable bosonic realization. Incorporating Haldane fractional exclusion statistics with parameter $g$ provides a continuous interpolation between the bosonic ($g = 0$) and fermionic ($g = 1$) limits, revealing a monotonic enhancement of maximum power for $g < 1$ at reduced bias cost. These results establish quantum statistical exclusion as a previously unrecognized and independently tunable thermodynamic resource, opening performance regimes inaccessible to conventional carrier-engineering approaches.
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Quantum Gases

On operator product expansion in the spin-orbit coupled bosonic system

Ultra-cold bosonic systems can be tuned to exhibit quantum phase transitions. For example, the Rabi-coupled bosonic system exhibits ferromagnetic and paramagnetic phases, whereas the spin-orbit-coupled system exhibits exciting phases such as supersolidity. The physics of these phases and phase transitions is very rich. It is an important topic of research to probe these phases and phase transitions using various tools in many-body physics. The operator product expansion (OPE) provides one such tool. It expresses the product of two separated operators as a series expansion of local operators. In this article, we will derive the OPE of two operators $\psi^\dagger_\sigma(\vec r)$ and $\psi_{\sigma'}(\vec r')$. More specifically, we look for the contact density term, which controls many of the universal physics of the underlying bosonic system.
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Mesoscale and Nanoscale Physics

Theory of nonlinear spin transport in chiral conductors

The chirality-induced spin selectivity (CISS) effect, discovered by Naaman and collaborators in 1999, describes the emergence of a finite spin polarization in response to current flow through a chiral electronic system. While extensive experimental studies have verified the presence of CISS in molecular systems and, more recently, in chiral materials, a complete microscopic understanding of this effect remains elusive. In this work, we propose a theoretical framework linking the CISS effect to the orbital Edelstein effect. In the latter, a drive current induces a finite orbital magnetization, even in the absence of spin-orbit coupling. Our non-equilibrium theory naturally explains key features of the CISS effect: its persistence in systems with weak or vanishingly small spin-orbit coupling and its connection to natural optical activity, a distinctive signature of chiral systems.
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Materials Science

Spin point group symmetry and classification of non-relativistic spin splitting in non-collinear magnetic structures: Identification of high-order spin splitting types (l=5,7, and 9)

A comprehensive study of the possible types of non-relativistic spin splitting of electronic bands in coplanar and non-coplanar magnetic structures is presented on the basis of spin-group theory. First, we tabulate all non-equivalent spin point groups (SpPGs) which can be expressed as a direct product of a nontrivial part and a spin-only group limited to be the intrinsic (trivial) one, or augmented by the time-reversal (TR) operation. This tabulation, which includes the listing of symmetry operations for 1249 nonequivalent SpPGs, is now available as an online database SPGENPOS in the Bilbao Crystallographic Server (BCS). This extends previous enumerations, in which the possible presence of TR in the magnetic point group was not taken into account, thus overlooking the full SpPG symmetry associated with the numerous magnetic structures which have a magnetic space group of type IV. For each of the listed coplanar and non-coplanar SpPGs, the spin-splitting that is symmetry allowed is analyzed in detail using the program STENSOR also in the BCS. Except for the SpPGs that include the operation 1', i.e., the combined operation of TR and space inversion, all other coplanar and non-coplanar SpPGs allow spin splitting at some order in a power expansion of the electron wave vector components. We find that, depending on the SpPG, spin-splitting terms can appear with the lowest-order monomials ranging from l=0 to 9, with the exception of l=8. This contrasts with the collinear case, where the lowest order is not higher than l=6, and where TR forbids any spin splitting. For the newly identified spin textures with powers l=5, 7, and 9, which are possible in some noncentrosymmetric SpPGs, the functional form of the spin splitting in terms of the components of the crystal momentum is given. One example of a real material, LaMnAu5, showing l=5 spin splitting is identified.
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All authors Luis Elcoro, Jesus Etxebarria, J. Manuel Perez-Mato, Emre S. Tasci