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Physics Condensed Matter

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Monday 6 April

Strongly Correlated Electrons

Strongly Correlated Superconductivity in Twisted Bilayer Graphene: a Gutzwiller Study

We study strongly correlated superconductivity in magic-angle twisted bilayer graphene (MATBG) using a variational Gutzwiller wavefunction $\ket{\Psi_G} = \prod_{\vb{R}} \hat{P}_{\vb{R}} \ket{\Phi_0}$, where the Gutzwiller projector $\hat{P}_{\vb{R}}$ is allowed to break charge U(1) symmetry to accommodate superconducting (SC) order. The ground state energy is evaluated via the Gutzwiller Approximation applied to an 8-band model consisting of correlated $f$-orbitals and uncorrelated $c$-orbitals, with interactions including onsite Coulomb repulsion $U$, phonon-mediated anti-Hund's coupling $\hat{H}_{J_A}$, and intra-orbital Hund's coupling $\hat{H}_{J_H}$. At filling $\nu = 2.5$, we map out the phase diagram as a function of $U$ and $J_A$, and reveal a strongly correlated SC (SC-SC) phase dominates at large $U$, wherethe strong on-site interaction U strongly suppress the $f$-orbital charge fluctuations while maintaining finite pairing order and a sizeable quasiparticle weight Z, distinguishing it from a conventional Mott insulator. For a range of $J_{\rm A}$, SC-SC transitions to FL as $U$ decreases, until the weakly correlated BCS-like SC (BCS-SC) re-enters as $U \to 0$. We further identify a novel small Fermi liquid (sFL) state with effective Fermi surface formed by $c$-orbitals, which is essentially different with the normal Fermi liquid. Interestingly, in the intermediate- ($U \lesssim 40$ meV) and large-$U$ ($U \gtrsim 40$ meV) regimes, the conventional FL and the sFL are the lowest-energy normal phases, respectively, potentially serve as the parent states of the SC-SC phase. These results illuminate the interplay between strong correlations and unconventional pairing in MATBG, and establish a versatile Gutzwiller framework applicable to other strongly correlated superconductors.
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All authors Matthew Shu Liang, Yi-Jie Wang, Geng-Dong Zhou, Zhi-Da Song, Xi Dai

Mesoscale and Nanoscale Physics · Cross-listed from physics.optics

Reduced Optical Gain Threshold by Carrier Multiplication in Semiconductor Perovskite Nanocrystals

Carrier multiplication (CM) describes a strong charge-carrier interaction process in semiconductor colloidal nanocrystals (NCs), wherein two band-edge excitons are simultaneously created by an absorbed photon with at least twice the bandgap energy (2 Eg). While being fundamentally intriguing, it has been exclusively utilized to enhance the light-to-electricity conversion efficiencies in the photodetector and solar-cell devices. In this report, we have synthesized the core/shell perovskite FAPbI3/NdF3 NCs with a biexciton recombination lifetime of ~3.9 ns, and demonstrated that a CM efficiency of ~25.7% can be achieved under the ~355 nm laser excitation (~2.21 Eg). This CM occurrence leads to a two-fold reduction in the optical gain threshold, as compared to that obtained under the ~640 nm laser excitation (~1.23 Eg). When combined with the single-exciton and zero-threshold optical gain schemes previously developed for semiconductor colloidal NCs, the CM effect introduced here would further mitigate the optical-pumping requirement for the routine operation of continuous-wave lasing.
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All authors Zhen Zhang, Encheng Sun, Jian Li, Chunfeng Zhang, Fengrui Hu, Min Xiao, Xiaoyong Wang

Statistical Mechanics

The Roaming Bethe Roots: An Effective Bethe Ansatz Beyond Integrability

We propose an effective Bethe ansatz (EBA) for solving quantum many-body systems near an integrable point. Our approach retains the functional form of the Bethe wave function while renormalizing the Bethe roots to account for integrability-breaking interactions. These effective roots are determined by minimizing physically motivated cost functions. The resulting off-shell Bethe states serve as approximate eigenstates of the non-integrable models. We assess the quality of the approximation using various physical observables, including the energy eigenvalue, state fidelity, and bipartite entanglement entropy. Our tests show that for models with weak integrability-breaking, the effective Bethe ansatz provides a high-quality approximation to the exact eigenstates over a wide range of deformation parameters. In contrast, for models with strong integrability-breaking interactions, the efficacy of the effective Bethe ansatz degrades relatively quickly as the deformation parameter increases. The efficacy of the method thus offers a useful probe for characterizing the strength of integrability breaking. Within its regime of accuracy, it also provides a new representation of the eigenstates of nearly integrable models, enabling one to exploit the algebraic structure inherited from integrability.
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Statistical Mechanics

Unified geometric formalism for dissipation and its fluctuations in finite-time microscopic heat engines

Microscopic heat engines operate in regimes where thermodynamic quantities fluctuate strongly, making stochastic effects an essential aspect of their performance. However, existing geometric formulations of finite-time thermodynamics primarily characterize average dissipation and do not systematically capture its fluctuations. Here, we develop a unified geometric framework that consistently describes both the mean dissipated availability and its fluctuations. In the linear-response regime, we show that these quantities are governed by metric tensors constructed from equilibrium correlation functions, providing a common geometric structure for dissipation and its fluctuations. This framework yields geometric bounds on both the mean and variance of the dissipated availability, and thereby on the efficiency and its fluctuations. The formalism applies broadly to stochastic systems, including Markov jump processes and overdamped and underdamped Brownian dynamics, establishing a unified geometric description across microscopic heat engines.
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Disordered Systems and Neural Networks

Breaking the Entanglement-Structure Trade-off: Many-Body Localization Protects Emergent Holographic Geometry in Random Tensor Networks

We present a systematic numerical investigation of the "entanglement geometry gravity" chain in random tensor networks (RTN) established by the ER EPR conjecture and Jacobson's thermodynamic derivation. First, we verify the kinematic foundation: the entanglement first law $\delta\langle K\rangle=\delta S$ (slope=1.000), the encoding of geometry by mutual information (correlation=0.92), and the locality of holographic perturbations (3.3x). We also confirm that gravitational dynamics (JT gravity) does not emerge, identifying a sharp kinematics-dynamics boundary. Second, and more importantly, we discover that many-body localization (MBL) is the mechanism that protects emergent holographic geometry from thermalization. Replacing Haar-random evolution (geometry lifetime $t\sim6$) with an XXZ Hamiltonian plus on-site disorder, we observe a finite-size crossover at disorder strength $W_c\approx10-12$ above which mutual-information-lattice correlations persist indefinitely ($r>0.5$ for $t>50$). We map the full parameter space: the optimal regime is a near-Ising anisotropy $\Delta\approx50$ with $W=30$ yielding $r=0.779\pm0.002$ (confirmed by a fine scan over $\Delta\in[30,70]$); only holographic (RTN) initial states sustain geometry, while product, Néel, and Bell-pair states do not. MBL preserves the spatial structure of entanglement (adjacent/non-adjacent MI ratio ~2.6-4.2x vs. 1.0x in the thermal phase), rather than its total amount. A comparison with classical cellular automata reveals that MBL uniquely breaks the entanglement-structure trade-off imposed by quantum monogamy: classical systems achieve spatial structure only at the cost of negligible mutual information, while MBL sustains both.
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Statistical Mechanics

Semi-Markovian Dynamics of a Self-Propelled Particle in a Confined Environment: A Large-Deviation Study

We study the large deviations of the time-integrated current for a self-propelled particle moving within a confined environment. The dynamics is modeled as a semi-Markovian process, where the transitions between a normal running phase (Phase $0$) and a wall-attached phase (Phase $1$) are governed by time-dependent reset probabilities. We study two different examples: In the first case, the particle undergoes a biased random walk in Phase $0$, while it intermittently resets and interacts with the container boundaries, remaining stationary in Phase $1$. In this scenario, the reset probabilities for transitions between the two phases follow an “aging” logic. In the second case, the particle alternates between two active phases: a Markovian Phase $0$ characterized by memoryless, downstream-biased motion, and a semi-Markovian Phase $1$ with a reversed, upstream bias representing boundary-attached navigation. Here, we assume a time-independent survival probability in Phase $0$ and a time-dependent one in Phase $1$. By analyzing the Scaled Cumulant Generating Function (SCGF) in the long-time limit, we derive the conditions for Dynamical Phase Transition (DPT)s in the fluctuations of the particle velocity. We demonstrate that, depending on the aging strength, the system exhibits either discontinuous (first-order) or continuous (second-order) DPTs. Analytical predictions are validated via computer simulations.
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Strongly Correlated Electrons

Harnessing the VO2 Phase Transition for Automatic Gain Control in Transimpedance Amplifiers

Transimpedance amplifiers (TIAs) are essential in sensor electronics, converting input currents into output voltages. Conventional TIAs utilize fixed-gain resistors, which saturate under high input currents and consequently result in undesirable recovery times. To overcome this limitation, volatile resistive switching devices have emerged as a promising alternative, offering intrinsic automatic gain control (AGC). Among these, vanadium dioxide (VO2) devices stand out for their reversible insulator-metal transition (IMT), producing abrupt, energy-efficient resistance changes near the transition temperature (67 C). In this work, a switching device was fabricated by sputtering a VO2 thin film and patterning 200 nm electrode gaps atop it. Before integrating this device into the TIA circuit, its switching dynamics were characterized under electrical pulse excitation. Slightly exceeding the temperature-dependent IMT threshold voltage (Vth) yielded fast and reproducible switching. Complementary pump-probe measurements showed that operating well below TC effectively suppresses short-term memory effects linked to the stochastic nature of the first-order transition. Leveraging these insights, a custom VO2-based TIA was developed, demonstrating variable gain and AGC functionality. Furthermore, applying a constant DC current bias during switching induced self-sustained oscillations (2 pJ per spike) with frequencies up to 60 MHz, consistent with the thermal timescale of the VO2 devices. Overall, these results provide a detailed understanding of VO2 switching dynamics and demonstrate their potential for enabling compact, energy-efficient AGC in high-speed TIAs for advanced sensing applications.
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All authors Amir Gildor, Sariel Hodisan, Shahar Kvatinsky, Yoav Kalcheim

Materials Science

Broken Symmetry-driven Weyl Semimetal Phase in Zn-Substituted EuMn$_2$Sb$_2$

The interplay between magnetism and electronic topology offers a powerful route to realizing emergent quantum phases. Here, we show that Zn substitution in the layered compound EuMn$_2$Sb$_2$ drives a transition from a C-type antiferromagnetic semiconductor to an intrinsic magnetic Weyl semimetal. Using first-principles calculations, we demonstrate that the parent compound hosts a gapped antiferromagnetic ground state, while Zn substitution alters the magnetic exchange interactions and stabilizes ferromagnetism. In the spin-orbit-coupled regime, the coexistence of broken time-reversal ($\mathcal{T}$) and inversion ($\mathcal{P}$) symmetries leads to the formation of Weyl nodes near the Fermi level. These nodes act as monopoles of Berry curvature and give rise to topologically protected Fermi-arc surface states. Our results identify EuMnZnSb$_2$ as a tunable platform where magnetism and topology are intrinsically coupled and establish chemical substitution as a viable strategy to engineer magnetic Weyl semimetals in correlated electron systems, with potential implications for spintronic and topological transport phenomena.
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Materials Science

Phonon-driven tuning of exchange interactions in Y3Fe5O12

Yttrium iron garnet (Y3Fe5O12) is a prototypical ferrimagnetic insulator widely used in spin-wave and magnonic devices owing to its extremely low magnetic damping and long magnon propagation length, and recent experiments suggest that lattice vibrations can influence magnetic properties, motivating a microscopic understanding of how phonons modify exchange interactions. In this work, phonon-driven tuning of exchange interactions in Y3Fe5O12 is investigated from a mode-resolved perspective based on first-principles calculations. We focus on how optical phonons modify the dominant superexchange pathways and how lattice distortions affect the Fe-O-Fe bond geometry that governs the exchange interaction. To this end, phonon modes are computed from density functional theory, and the exchange interactions are evaluated from a Wannier-based tight-binding model and mapped onto a spin Hamiltonian, while displaced structures along individual infrared-active modes are used to quantify their impact on the magnetic interactions.
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Materials Science

Light-modulated exchange bias in multiferroic heterostructures

Magnetic straintronics, the strain-mediated control of magnetic anisotropy, has emerged as a key direction for next-generation energy-efficient technologies. In multiferroic heterostructures, magnetoelectric coupling is typically achieved by applying an electric field on a ferroelectric phase, inducing strain through the converse piezoelectric effect, which is then transferred to the adjacent ferromagnetic phase. As an alternative, strain can be remotely modulated through the photostrictive effect induced by light. While light-driven control of magnetic anisotropy has been explored, optical modulation of more complex phenomena such as exchange bias remains largely unaddressed. Here, we demonstrate significant light-induced modulation of exchange bias and magnetization switching at room temperature in a Pb(Mg1/3Nb2/3)O3-Pb(Zr,Ti)O3 (PMN-PZT)/Fe80Ga20(FeGa)/Ir20Mn80(IrMn) multiferroic heterostructure, driven by visible-light-photostriction. The magnetization state correlates with the light intensity, enabling multi-level states with light power densities as low as 0.1 W cm-2. These findings suggest a promising route toward low-power, multistate, and wireless opto-magnetic memory applications.
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All authors Huan Tan, Zheng Ma, Cynthia Bou Karroum, Matthieu Liparo, Jean-Philippe Jay, David Spenato, David T. Dekadjevi, Luis Martinez Armesto, Alberto Quintana, Jordi Sort

Mesoscale and Nanoscale Physics

Nonreciprocal current induced by dissipation in time-reversal symmetric systems

We study nonreciprocal current response in noncentrosymmetric crystals under time-reversal symmetry. We reveal that the nonreciprocal current appears in a dissipative system through interband processes. We derive a formula for the nonreciprocal current using the Green's function technique. The nonreciprocal current of the present mechanism turns out to be of $O(1/\tau)$ ($\tau$: the lifetime of Bloch electrons) and arises from the shift of the electron wave packet during the interband processes which has a geometric origin. We present a numerical simulation of the nonreciprocal current in the one-dimensional Rice-Mele model and give its order estimation for nonmagnetic polar semiconductors.
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Materials Science

Epitaxial MgSnN2 on 4H-SiC (0001): An Earth-Abundant Nitride for Green Optoelectronics and Photovoltaics

Group II-IV nitrides have recently emerged as a novel class of semiconductors composed of earth-abundant elements. Owing to their tunable bandgaps, comparable to those of III-nitrides, these materials are attractive candidates for replacing expensive Ga-based alloys in photovoltaics and green-gap optoelectronics. In this work, epitaxial growth of MgSnN2 layers on 4H-SiC(0001) substrates by direct current magnetron sputtering is demonstrated. Mg and Sn metal targets have been co-sputtered in nitrogen-containing atmosphere at growth temperatures up to 500 {\deg}C. X-ray diffraction and cross-sectional transmission electron microscopy confirm the MgSnN2 layers grow epitaxially in a wurtzite crystal structure, exhibiting the epitaxial relationships with the substrate: MgSnN2 [0001]//4H-SiC [0001] and MgSnN2 [10-10]//4H-SiC[10-10]. Improved crystalline quality is observed for higher deposition temperatures and near-stoichiometric composition, as evidenced by the narrowing of rocking curve linewidths. Optical characterization reveals high absorption coefficients (1e5 cm-1) in the visible spectrum, comparable to that of GaAs, highlighting the suitability of MgSnN2 for photovoltaic applications. A photoluminescence emission band at ~2.4 eV is detected, highly desirable for optoelectronic devices operating in the challenging green spectral region. These results establish MgSnN2 as an earth-abundant, environmentally friendly material, structurally compatible with III-nitrides, with potential for cost-efficient components in sustainable optoelectronics and photovoltaics.
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All authors D. Gogova, D. Tran, V. Stanishev, D. Shafizadeh, C.-L. Hsiao, M. Kim, B. Pécz, A. Kovács, K. Frey, A. Sulyok, N. K. Singh, A. Le Febvrier, P. Eklund, V. Darakchieva

Disordered Systems and Neural Networks

The Bott Metric: A Real-Space Bridge Between Topology and Quantum Metric

The Bott index has become an indispensable tool to probe the topology of quantum matter, particularly in systems lacking translational symmetry. Constructed from a plaquette operator, it retains the phase information while discarding the amplitude. Here we introduce and develop the Bott metric, which captures this complementary amplitude information and provides a measure of the underlying quantum metric of the system. We show that, in the thermodynamic limit, the Bott metric converges to the trace of the integrated quantum metric. Our framework provides a new route to reveal the quantum metric structure in non-periodic systems, which we illustrate using representative examples ranging from disordered to amorphous models. More broadly, our definition of the Bott metric unifies the notion of topological invariants and quantum metric under the same overarching plaquette operator construction.
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All authors Kaustav Chatterjee, Ronika Sarkar, Md Afsar Reja, Awadhesh Narayan

Materials Science

Atomic Structure of Grain Boundaries, Dislocations and Associated Strain in Templated Co-evaporated Photoactive Halide Perovskites

Structural defects, particularly grain boundaries, play a crucial role in governing charge transport and the optoelectronic properties of metal halide perovskites, thereby limiting the performance of devices. Solar cells incorporating templated FA0.9Cs0.1PbI3-xClx show significant improvements in grain orientation and steady-state power conversion efficiency; however, the underlying mechanisms remain unclear. In this study, we address this gap by employing a suite of tailored low-dose electron microscopy techniques to investigate the templated FA0.9Cs0.1PbI3-xClx film, revealing that it exhibits a preferred crystallographic orientation along the <001> zone axis, with arbitrary grain rotations about that axis, indicative of a Volmer-Weber growth mechanism. We determine the atomic structure of the resulting high-angle and low-angle grain boundaries. We also reveal the presence of edge dislocations and their associated strain fields, demonstrating the compressive strain on one side of the dislocation core and tensile strain on the opposite side. Furthermore, we find dislocations associated with stacking faults. These atomic-level insights uncover which grain boundaries and intra-grain defects are likely to act as recombination centres or modify band gaps, crucial for understanding which defects influence the performance of perovskite solar cell devices.
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All authors Huyen T Pham, Siyu Yan, Zhou Xu, Weilun Li, Sergey Gorelick, Michael B Johnston, Joanne Etheridge

Mesoscale and Nanoscale Physics · Cross-listed from quant-ph

Digital-Analog Quantum Simulation and Computing: A Perspective on Past and Future Developments

Quantum simulation and computing traditionally has been based on two main paradigms, namely, digital and analog. In the digital paradigm, usually single and two-qubit gates (where qubit is an acronym for quantum bit) are employed as building blocks for scalable, universal quantum computing, although errors add up fast and error correction will be ultimately needed for scaling up. In the analog paradigm, large analog blocks are normally employed for a unitary dynamics that carries out the computation, enabling quantum operations on many qubits with reduced errors, but with the drawback of a limited choice of evolutions and lack of universality. In the past decade, a new paradigm has emerged, showing interesting possibilities for quantum simulation and computing in the near and mid term. This is the paradigm of digital-analog quantum technologies, which proposes to combine the best of both paradigms: large analog blocks, provided by native interactions of the employed quantum platform, enabling scalability, combined with digital gates, allowing for more versatility and, ultimately, universality. In this Perspective, I give an overview of the evolution of the field along the past decade, and an outlook for its future possibilities.
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Quantum Gases

Neural-network quantum states for solving few-body problems: application to Efimov physics

Neural-network quantum states have recently emerged as a powerful method for solving quantum many-body problems, with notable successes in lattice systems. Here, we extend this approach to strongly interacting few-body problems in continuous space, and demonstrate its capability by computing the Efimov states and associated few-body bound states. Using a fully connected feedforward neural network with Jacobi coordinates as inputs, combined with a projection method, we compute the ground and first excited states for three- to six-body systems of identical bosons at unitarity, as well as a mass-imbalanced fermionic system consisting of two identical fermions and a third particle. The obtained energies of the ground and first excited states agree well with previously reported results. Furthermore, the proposed approach also reproduces key features of Efimov states, including the discrete scale invariance, the characteristic geometric structure of the wave function, and the critical-mass behavior in mass-imbalanced fermionic systems. Our method can be readily applied to a broad class of strongly correlated few-body problems in continuous space.
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Materials Science

Collective Electrostatics and Band Alignment in Janus MoSTe nanotubes

In this work, we investigate the collective electrostatic effects of one-dimensional (1D) Janus MoSTe nanotubes and their impacts on the band alignment of nanotube heterostructures. Using first-principles calculations based on Density Functional Theory, we find that the Janus nanotube generates a large and uniform electrostatic potential of over 1.3 V within the nanotube pores, which is accumulative for double wall nanotubes. We develop an analytical model to provide a quantitative understanding of the electrostatic potential and its dependence on the quadrupole moment and nanotube radius. For double wall MoSTe nanotube, we find a substantial band edge shift of about 1.0 eV for the inner tube originated from the electrostatic effects, leading to a type-II band alignment. These results demonstrate that the electrostatic effects of 1D nanotubes can be used to tune the electronic properties and band alignment of 1D nanotube heterostructures for optoelectronic and catalytic applications.
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All authors Adithya Sadanandan, Tyson Karl, Rahil Shaik, Qunfei Zhou

Strongly Correlated Electrons · Cross-listed from hep-th

D-instanton Effects on the Holographic Weyl Semimetals

We investigate the effects of D-instantons on a holographic Weyl semimetal in a top-down approach. We find that the presence of D-instantons induces a novel phase transition from a Weyl semimetal to a gapped phase, providing a new mechanism for gap formation in strongly coupled systems. By analyzing the free energy of probe D7-brane embeddings, we construct the phase diagram in terms of the fermion mass, instanton density, and temperature, measured in units of the Weyl parameter. We show that, in addition to the conventional mass-driven transition associated with band inversion, the instanton density gives rise to a qualitatively different transition whose mechanism cannot be understood within the standard Dirac picture. We compute nonlinear electric conductivities from the regularity condition at the black hole horizon and demonstrate that the two types of transitions exhibit distinct transport behavior. In particular, the instanton-induced transition leads to a gapped phase with properties that differ from the conventional insulating phase. We also discuss possible interpretations of this phase in the boundary theory and comment on its relation to nonperturbative effects in strongly interacting systems.
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Superconductivity

Multimodal Terahertz Spectroscopy of the Pairing Symmetry and Normal-State Pseudogap in (La,Pr)$_3$Ni$_2$O$_7$ Films

The discovery of ambient-pressure superconductivity in compressively strained (La,Pr)$_3$Ni$_2$O$_7$ thin films has intensified efforts to identify the pairing mechanism. However, the symmetry of the superconducting order parameter and the character of the normal state remain unsettled. Here we combine bulk-sensitive terahertz (THz) time-domain spectroscopy with THz third-harmonic generation to present spectroscopic insights into these issues. Linear THz spectroscopy reveals a bulk superconducting response in the (La,Pr)$_3$Ni$_2$O$_7$ films, evidenced by the suppression of low-frequency spectral weight below the onset critical temperature, $T_\mathrm{c}^{\mathrm{onset}}$. A weak coherence peak near $T_\mathrm{c}^{\mathrm{onset}}$, together with substantial residual low-frequency conductivity as $T\to 0$, is consistent with disordered $s_{\pm}$-wave pairing. In the nonlinear regime, the third-harmonic signal rises sharply on cooling through $T_\mathrm{c}^{\mathrm{onset}}$, providing an independent signature of the transition. Strikingly, the nonlinear response persists above $T_\mathrm{c}^{\mathrm{onset}}$, pointing to either disorder-enhanced nonlinearity or a distinct correlated normal state. Motivated by angle-resolved photoemission spectroscopy on similarly grown films that identifies a comparable temperature scale, we associate the anomalous normal-state terahertz nonlinearity with a pseudogap. These results establish (La,Pr)$_3$Ni$_2$O$_7$ as a bulk superconductor with $s_{\pm}$-like pairing that coexists with, and may compete with, a distinct ordered state, providing a platform for exploring unconventional superconductivity beyond cuprates and pnictides.
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All authors Shuxiang Xu, Guangdi Zhou, Hao Wang, Tianyi Wu, Wei Wang, Liyu Shi, Dong Wu, Haoliang Huang, Xinbo Wang, Jinfeng Jia, Qi-Kun Xue, Zhuoyu Chen, Tao Dong, Nanlin Wang

Disordered Systems and Neural Networks

Solvable model of noisy coupled oscillators with fully random interactions

We introduce a solvable spherical model of coupled oscillators with fully random interactions and distributed natural frequencies. Using the dynamical mean-field theory, we derive self-consistent equations for the stationary response and correlation functions. We show that the finite-temperature spin-glass transition is suppressed for any nonmonodisperse natural-frequency distribution, including continuous, discrete, and asymmetric distributions, because the resulting low-frequency singularity of the correlation function is incompatible with the spherical constraint. At zero temperature, however, a spin-glass phase persists for arbitrary frequency dispersion. This residual zero-temperature glassiness is likely a special feature of the spherical dynamics and would be destroyed by local nonlinearities. The model thus provides a solvable oscillator framework for studying how nonequilibrium perturbations suppress finite-temperature glassy freezing.
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Strongly Correlated Electrons

Real-space determination of orbital states driving successive phase transitions in FeV2O4

Direct experimental access to orbital states in strongly correlated materials remains a major challenge, despite their central role in driving coupled structural and magnetic phase transitions. In systems where electronic correlations, electron-lattice coupling, and relativistic spin-orbit interactions compete on comparable energy scales, even first-principles calculations often yield multiple metastable solutions, hindering the unambiguous identification of the ground state. Here, we demonstrate that the orbital states of the spinel oxide FeV2O4, which possesses active orbital degrees of freedom on both Fe and V ions, are uniquely resolved by combining valence electron density (VED) analysis based on state-of-the-art synchrotron x-ray diffraction with spin-polarized density-functional-theory calculations. Our results reveal that temperature-dependent rearrangements of orbital occupations drive successive structural transitions that accompany collinear and noncoplanar ferrimagnetic orders, establishing a direct correspondence between orbital anisotropy and spin structure. More broadly, this work shows that experimentally determined VED provides a decisive real-space constraint on competing theoretical solutions, offering a powerful and broadly applicable framework for elucidating the microscopic mechanisms of complex phase transitions in strongly correlated electron systems.
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All authors Chihaya Koyama, Yusuke Nomura, Shunsuke Kitou, Taishun Manjo, Yuiga Nakamura, Takeshi Hara, Naoyuki Katayama, Yoichi Nii, Ryotaro Arita, Hiroshi Sawa, Taka-hisa Arima

Materials Science

Comprehensive determination of Burgers vectors of threading dislocations in GaN substrates by combining reflection and transmission synchrotron-radiation x-ray topography

Burgers vectors (b) of threading dislocations (TDs) in an acidic ammonothermal-grown GaN substrate were investigated using synchrotron radiation x-ray topography (SR-XRT) by combining both reflection and transmission modes. Reflection XRT images recorded with six equivalent g vectors of 11-24 revealed spot-like contrasts corresponding to TDs. Based on the contrast conditions, the possible Burgers vectors were constrained, and the c-axis component of b for mixed-type TDs was estimated from the contrast size. Using transmission XRT images recorded under several two-beam diffraction conditions, the (0001) in-plane direction of b was evaluated based on the gb invisibility criterion. Furthermore, by analyzing the linewidths of dislocation images observed under kinematical diffraction contrast, the magnitude of the a-axis component of b was determined. By combining these analyses, the Burgers vectors of individual TDs, including edge- and mixed-type dislocations, were determined. In addition, a pair of screw-type TDs with opposite Burgers vectors, +1c, -1c, was observed in the transmission SR-XRT. These results demonstrate that the combined use of reflection and transmission SR-XRT provides a practical approach for complete determination of Burgers vectors in GaN substrates.
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All authors Kazuki Ohnishi, Kenji Iso, Hirotaka Ikeda, Yoshiyuki Tsusaka, Yongzhao Yao

Materials Science

Ultrafast Non-Volatile Weyl LuminoMem for Mid-Infrared In-Memory Computing

Integrated optoelectronic systems strive to combine the logic/memory density of electronics with the bandwidth of photonics, but monolithic realization is impeded by the inefficient electronic-to-photonic interface. Current architectures rely on separate readout circuitry and modulators, creating bottlenecks in energy and latency, while existing direct transduction methods often compromise on switching speed or non-volatility. Here, we report an ultrafast, non-volatile optoelectronic memory, named LuminoMem, that integrates electrical storage and mid-infrared light emission in a single device. The device utilizes a floating-gate architecture, in which the Weyl semiconductor tellurium serves simultaneously as a charge-trapping storage layer and an emissive medium. This design enables nanosecond-scale electrical programming of non-volatile photoluminescence at 3.4 um, allowing direct optical access to stored states without external modulation. We demonstrate 4-bit (16-level) optical storage capacity and validate the device's performance through neural network simulations that achieve high accuracy on the Fashion-MNIST dataset. By effectively bridging the gap between electronic storage and mid-infrared photonics, the demonstrated mid-infrared LuminoMem provides a hardware foundation for promoting current computation efficiency and potential intelligent platforms that co-integrate computing, memory, and sensing capabilities.
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All authors Delang Liang, Shiyu Wang, Yan Wang, Dong Li, Yuchun Chen, Bin Cheng, Mingyang Qin, Dehong Yang, Jie Sheng, Lin Li, Changgan Zeng, Dong Sun, Anlian Pan, Jing Liu

Statistical Mechanics · Cross-listed from quant-ph

Measurement-enhanced entanglement in a monitored superconducting chain

A common view in monitored quantum dynamics is that local measurements suppress entanglement growth. We show that this intuition can fail in a one-dimensional spinful fermionic chain governed by a BCS Hamiltonian with pairing strength $\Delta$ and subject to continuous, on-site, spin-resolved charge measurements at rate $\gamma$. Using free-fermion simulations and quasiparticle analysis, we show that pairing suppresses entanglement growth, while measurements suppress pairing. Their competition yields measurement-enhanced entanglement: for $\Delta>0$, the steady-state entanglement $\mathcal{S}_s$ increases with $\gamma$ over a finite interval $0<\gamma<\gamma_{\mathrm{peak}}$. This occurs because stronger measurements suppress pairing correlations, which would otherwise suppress entanglement growth. Using a nonlinear sigma-model calculation and free-fermion simulations, we provide evidence that for $\Delta>0$ and small but finite $\gamma$, the steady-state entanglement scales as $\mathcal{S}_s(L)\sim \ln^2 L$. This implies that, in this setting, measurement-enhanced entanglement does not persist in the thermodynamic limit.
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Strongly Correlated Electrons

Topological Phase Transitions and Their Thermodynamic Fate in Arbitrary-$S$ Classical Pyrochlore Spin Ice

We develop a self-contained theoretical framework that classifies the topological phases and critical phenomena of classical pyrochlore magnets with arbitrary spin $S$, subject to competing exchange and single-ion anisotropies. We work first in the monopole-free (ice-rule) limit. In the small-$w$ regime, where the single-ion term favors low spin amplitudes, dualities reveal a dichotomy: Integer spins exhibit a continuous 3D $XY$ deconfinement transition, whereas half-integer spins remain in a $U(1)$ Coulomb liquid without any transition. In the large-$w$ regime, where $|S^z| = S$, the macroscopic flux is quantized to multiples of $2S$. Mapping the defect structure to loop gases, we prove that the ice rule is compatible with the modular $\mathbb{Z}_{2S}$ flux conservation at the vertex level if and only if $S \le 3/2$. For $S=3/2$, this maps the system to the three-state Potts model, whose symmetry-allowed cubic invariant drives a first-order transition. For $S \ge 2$, no discrete clock mapping exists; a decomposition of the partition function shows that the only processes sensitive to the discrete $\mathbb{Z}_{2S}$ structure carry exponentially small weight and correspond to irrelevant operators at the 3D $XY$ fixed point, so the deconfinement transition is of the 3D $XY$ type. Finally, incorporating thermal monopoles, we show that they act as a symmetry-breaking effective magnetic field that severs defect strings. Consequently, the continuous transitions are rounded into crossovers, whereas the first-order $S=3/2$ transition is predicted to survive at finite temperatures, terminating at a critical end point. Classical Monte Carlo simulations for $S$ up to $7/2$ corroborate the predicted crossovers at the accessible temperatures, which lie above the estimated critical end point, so the survival of the $S=3/2$ first-order transition remains to be tested directly.
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Strongly Correlated Electrons · Cross-listed from physics.chem-ph

Assessing the impact of nodal surface optimization in fixed-node diffusion Monte Carlo on non-covalent interactions

Diffusion quantum Monte Carlo (DMC) and coupled cluster theory [CCSD(T)] are widely-employed benchmark methods for noncovalent interactions (NCIs). However, recent studies have reported notable discrepancies across several hydrogen-bonded and dispersion-dominated systems, raising questions on the accuracy of the approximations underlying each approach. In DMC, the dominant error is expected to stem from the fixed-node approximation, where the nodal surface is typically taken from a single Slater determinant derived from a density functional theory or Hartree-Fock calculation. In this work, we assess the impact of nodal surface optimization on DMC predictions for 12 compounds spanning diverse NCIs, using a recently proposed antisymmetrized geminal power ansatz with natural orbitals. We find improved agreement with CCSD(T) for hydrogen-bonded systems, while having negligible effect for dispersion-dominated systems. These results provide a practical and computationally efficient route to resolving discrepancies in hydrogen-bonded interactions, while offering insight into the remaining differences in dispersion-dominated systems.
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All authors Kousuke Nakano, Benjamin X. Shi, Dario Alfè, Andrea Zen

Sunday 5 April

Materials Science

Kinetics studies on $\kappa$ to $\beta$-Ga$_2$O$_3$ phase transformations via in-situ high temperature X-ray diffraction

The kinetics of the $\kappa$ to $\beta$-Ga$_2$O$_3$ phase transformation were investigated in five batches of nominally phase-pure $\kappa$-Ga2O3 thin films heteroepitaxially grown on c-plane sapphire, with film thickness ranging from 700 to 1100 nm, using in-situ high-temperature X-ray diffraction. Phase fractions were quantitatively extracted through modified Rietveld refinement that accounts for preferred orientation, and the transformation kinetics were analyzed using the Johnson-Mehl-Avrami-Kolmogorov (JMAK) model. The applicability of the JMAK model to thin-film materials was evaluated and its lower and upper bounds for thin films and bulk materials were established. Based on this analysis, a method specifically suited for thin-film kinetic studies was developed and yielded reproducible and robust results across all five sample batches. The results indicate that the $\kappa$ to $\beta$ phase transformation in ~700-1100 nm films is best described as an interface-controlled, site-saturated nucleation with thickness-limited or effectively two-dimensional growth.
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All authors Jingyu Tang, Po-Sen Tseng, Kunyao Jiang, Rachel C. Kurchin, Robert F. Davis, Lisa M. Porter

Mesoscale and Nanoscale Physics · Cross-listed from physics.comp-ph

High-fidelity simulations of shock initiation of an energetic crystal-binder system due to flyer impact

Meso-scale simulations of energy localization at hotspots provide closure models for multiscale frameworks of shock-to-detonation transition (SDT). Validation of such meso-scale calculations is challenging as direct comparison with experiments is constrained both by limitations of data acquisition in the experiments (e.g., of temperature fields) and modeling over-simplifications in the simulations. To address the latter problem and bring modeling closer to experiments, we advance a high-fidelity meso-scale computational framework for interface-resolved reactive calculations of shock initiation in plastic-bonded explosives (PBXs). Accurate resolution of shock and interfacial dynamics is achieved through higher-order (5th-order WENO) schemes, and sharp interface treatments are implemented for physically accurate material-material interactions. Recently obtained atomistics-consistent material models are used for HMX, with the grid resolution taken down to atomistic scale (O(nm)). The crystal geometries are obtained directly from experiments via nano-CT imaging. The impacting flyer plate, energetic crystal and binder are tracked as distinct phases, and flyer-binder impact and separation are simulated, capturing the flyer deformation and the effects of relief waves from the flyer surface. By combining these high-fidelity modeling components, we evaluate how closely simulations can approach experimental data. Overall, this work provides as assessment of which aspects of numerical treatment and material modeling have the greatest impact on meso-scale simulations of flyer-induced initiation of PBXs, and points to where further improvements are necessary.
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All authors Shobhan Roy, Pradeep K. Seshadri, Chukwudubem Okafor, Belinda P. Johnson, H. S. Udaykumar

Strongly Correlated Electrons

BosonFlow: A C++ codebase for dynamic fRG and single-boson exchange in correlated fermion systems

We present a unified C++ implementation of the functional renormalization group and the parquet equations within the single-boson exchange formalism for several paradigmatic tight-binding and impurity models at equilibrium. The implementation computes the full dynamic vertex and self-energies, with momentum dependence treated using a truncated unity framework. We implement multiple self-energy flow equations, cutoff schemes, and extensions ranging from the dynamical functional renormalization group to multiloop flow equations that incorporate cutoffs in both the propagator and the interaction. The codebase serves as a reference for recent developments in the fRG and parquet methods for correlated electron systems and provides a flexible foundation for developing new many-body approaches and extensions.
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Quantum Gases · Cross-listed from quant-ph

Three Hamiltonians are Sufficient for Unitary $k$-Design in Temporal Ensemble

Unitary $k$-designs are central to quantum information and quantum many-body physics, as they provide efficient proxies for Haar-random dynamics. We study how chaotic Hamiltonian evolution can generate unitary $k$-designs using the frame potential (FP). Unlike standard approaches based on independently sampled Hamiltonians or fine-tuned evolution times, we consider a quenched temporal ensemble in which the Hamiltonians are sampled once and then held fixed, while randomness enters only through the evolution times. We compare a two-step protocol (2SP), with evolution under two fixed Hamiltonians, to a three-step protocol (3SP) with one additional quench, with three evolution times sampled independently. Analytically and numerically, we show that the 2SP fails to realize general unitary $k$-designs, whereas the 3SP realizes them for arbitrary $k$. The random phases in the 3SP impose stronger index-matching constraints in the FP, eliminating the independent permutation degrees of freedom that still remain in the 2SP. Even with imperfect time averaging, the 3SP reaches a given accuracy within a parametrically shorter time window. These results hold universally across different symmetry classes and persist in both all-to-all and local models with random interactions.
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