Materials Science
Electron Beam Radiolysis-Assisted Growth of Rutile TiO2 Thin Films
Silu Guo, Nitin Sathish Kumar, Sreejith Nair et al. (+3 more)
A new approach for growing crystalline thin films is developed that takes advantage of electron beam radiolysis being a constructive force to rearrange atoms into a crystalline structure. It is demonstrated that by irradiating the surface of a TiO2 film by an electron beam supplied by a reflection high energy electron diffraction (RHEED) gun inside the MBE chamber during growth, a crystalline film can be grown at much lower substrate temperatures, where deposited films typically appear amorphous. Here, rutile TiO2 films were grown using hybrid molecular beam epitaxy (MBE) allowing atomic level control of growth as well as an observation of radiolysis-driven crystallization. Analysis was carried out using a combination of SEM and atomic-resolution STEM imaging. It is also shown that by tuning the temperature of the substrate and the dose of the electron beam, the degree of crystallinity of the film can be controlled.
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All authors Silu Guo, Nitin Sathish Kumar, Sreejith Nair, Supriya Ghosh, Bharat Jalan, K. Andre Mkhoyan
Materials Science
Temperature-driven sodium-ion dynamical-to-static crossover in the zig-zag ordered phase of Na$_{0.5}$CoO$_2$
Shangfei Wu, Hengxin Tan, Dong Wu et al. (+7 more)
We employ polarization-resolved Raman spectroscopy combined with first-principles calculations to study the sodium-ion
lattice dynamics in a sodium zig-zag ordered cobaltate compound Na$_{0.5}$CoO$_2$. We detect two sodium
phonon modes for the first time, and their mode frequencies are consistent with first-principles
phonon calculations based on an orthorhombic unit
cell. We find that they appear below around $T^*\sim300\pm50$K with large linewidth broadening, much lower than the sodium zig-zag ordering temperature $T_\text{S}\sim460$K, and then narrow at lower temperatures. We interpret the sodium-
phonon anomalies occurring at $T^*$ as a dynamical-to-static crossover involving mainly the motion of sodium ions. Our results suggest that the gradual freezing of the sodium ions and the well-defined static sodium-zigzag order below $T^*$ set the stage for the emergent electronic and
magnetic orders in the CoO$_2$ layer of Na$_{0.5}$CoO$_2$.
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All authors Shangfei Wu, Hengxin Tan, Dong Wu, Mingshu Tan, Xinyu Zhou, Tianchen Hu, Tao Dong, Feng Jin, Qingming Zhang, Nanlin Wang
Materials Science
First-principles Study of Structural and Electronic Properties of Mn-doped Cu2NiXY4 (X=Sn, Ge, Si; Y=S, Se) Chalcogenide Semiconductors
Iskandar Raufzoda, Dilshod Nematov and Amondullo Burhonzoda
In this work, the effect of partial substitution of Mn by Ni on the structural and electronic properties of kesterite systems Cu2NiXY4 (X = Sn, Ge, Si; Y = S, Se) was studied using density functional theory (DFT). The mBJ+U method was used to characterize the bandgap more accurately. To the best of our knowledge, a systematic comparative study of Mn substitution in the entire Cu2NiXY4 (X = Sn, Ge, Si; Y = S, Se) family has not been previously performed. Due to crystallographic constraints of the kesterite unit
cell, the substitution of a single Ni atom with Mn corresponds to 50%. This configuration was chosen to study the effect of Mn substitution on the structural and electronic properties of Cu2NiXY4 (X = Sn, Ge, Si; Y = S, Se) compounds, whereas the study of lower concentrations requires the use of a supercell and is the subject of further research. The calculation results show that the partial substitution of Ni with Mn preserves the tetragonal structure of kesterite and significantly alters the electronic structure. In all the compounds studied, the bandgap decreases from 1.028-3.397 to 1.007-3.333 eV. For example, in the Cu2NiSnS4 system, the bandgap width decreases from 1.59 eV to 1.49 eV. The narrowing of the bandgap results from hybridization between the Mn-3d, Cu-3d, and S/Se-p orbitals near the band edges, leading to a redistribution of electronic states around the
Fermi level. The results demonstrate that Mn substitution is an effective strategy for controlling the electronic properties of Cu2NiXY4 kesterites, offering great promise for use in optoelectronic devices where adjustable bandgaps are required.
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Materials Science · Cross-listed from physics.comp-ph
A Showcase of Using the Partial-Structure R1 to Assemble Small-Molecule Crystal Structures
Xiaodong Zhang
Using a few concrete examples this paper has demonstrated a few observations on using the partial-structure R1 (pR1) to assemble small-molecule
crystal structures. (1) Assembling can start with orienting and/or placing large fragments or small fragments containing heavy atom(s). (2) It is handy to attach a fragment to a partial model as only the orientation needs to be optimized. (3) In a structure containing heavy atoms it is impossible to directly calculate the orientations of a light-atom-only fragment. Instead, it is necessary to use residual reflection intensities in which the contribution of the partial model containing all heavy atoms is deducted away. These observations indicate that pR1 is a useful tool for solving some small-molecule
crystal structures.
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Mesoscale and Nanoscale Physics · Cross-listed from quant-ph
Wireless millikelvin interconnects for superconducting quantum hardware
Kristopher Barr, Mingyan Zhong, Euan Parry et al. (+8 more)
Scalable
quantum computing is limited by the dense network of electrical interconnects linking cryogenic
quantum processors to room-temperature control electronics. To overcome this bottleneck, considerable effort has focused on cryogenic CMOS electronics and microwave-to-optical transduction, aiming to reduce wiring complexity and thermal loading. Wireless interconnects have recently emerged as a promising complementary approach, yet their compatibility with superconducting
quantum hardware remains largely unexplored. Here, we demonstrate the wireless excitation of a superconducting microwave resonator of the type routinely employed for
qubit readout, operating at millikelvin temperatures inside a dilution refrigerator. By directly comparing wired and wireless operation within the same cryogenic environment, we show that wireless coupling preserves the intrinsic resonator response while revealing parasitic electromagnetic pathways arising from stray radiation within the cryostat enclosure. These results establish a framework for the co-design of wireless interconnects, cryogenic packaging and superconducting
quantum hardware.
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All authors Kristopher Barr, Mingyan Zhong, Euan Parry, Manoj Stanley, Qusay Al-Taai, Paniz Foshat, Kaveh Delfanazari, Martin Weides, Nick M. Ridler, Chong Li, Alessandro Rossi
Statistical Mechanics
Cooling rate and glassy behavior in the Fermi–Pasta–Ulam system
Matteo Razza, Andrea Carati and Luigi Galgani
In this work, we numerically studied the cooling process of a
Fermi–Pasta–Ulam system, which occurs when the FPU system is placed in contact with a gas whose temperature $T$ is reduced with a certain cooling rate $\xi$. It was found that the existence of a weak
stochastic threshold has a significant impact on the cooling process, because below such a
stochastic threshold the specific FPU energy is larger than its temperature, i.e., the FPU system falls out of
equilibrium. The difference remains finite in the limit $T \to 0$, so that the FPU system maintains a residual amount of energy $E_0$ at vanishing temperature. Our numerical simulations reveal that this energy exhibits a power–law dependence on both the system size and the cooling rate, scaling approximately as $E_{0} \sim (\xi N)^{2/3}$.
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Strongly Correlated Electrons
Fractional Chern insulators in alternating twisted multilayer MoTe$_{2}$
Xi-Hang Feng, Shi-Ping Ding, Xiang-Jian Hou et al. (+2 more)
We study strongly correlated many-body states in alternating twisted trilayer and tetralayer MoTe$_{2}$. By sliding the top layer with respect to others and applying a perpendicular electric field, a variety of band structures can be realized. In many cases, the topmost hole band has unity Chern number and its
quantum geometric properties can be tuned to some extent. Exact diagonalizations suggest that fractional Chern
insulators are stabilized in certain parameter regimes but not in some regimes even when the band is topological. This contrast is attributed primarily to different
quantum geometries as quantified by the trace condition. Our results demonstrate that sliding can serve as a useful knob for probing many-body states in moiré systems.
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All authors Xi-Hang Feng, Shi-Ping Ding, Xiang-Jian Hou, Ying-Hai Wu, Jin-Hua Gao
Materials Science
Mapping recrystallization trajectories in GaAs using latent space diffraction analysis
Ellis Rae Kennedy, Kwanghwi Je and Erik Thiede
Recrystallization in disordered solids proceeds through a sequence of local structural rearrangements that are difficult to resolve using conventional diffraction analysis. In amorphous and partially ordered materials, subtle variations in diffuse scattering, short-range order, and defect-mediated
symmetry emergence encode the pathways through which ordering initiates and propagates. Here, we introduce a latent space framework for mapping these pathways directly from in situ 4D-STEM diffraction data. A convolutional autoencoder provides a compact representation of structural motifs, and unsupervised clustering identifies recurring microstructural states, including amorphous, paracrystalline, crystalline, twinned, and hybrid intermediates. By tracking these states across temperature, we construct phase trajectory models that reveal the
topology of the recrystallization landscape, including metastable basins, branching pathways, hybrid states, and temperature-dependent reorganizations of accessible states. Applied to ion irradiated GaAs, this approach uncovers two distinct recrystallization regimes separated by a transition near 250\textdegree{}C. At low temperature, recrystallization is growth-dominated and dominated by the persistence of amorphous and crystalline states. At high temperature, the transformation landscape reorganizes: hybrid and faulted states become metastable precursors to twinning, polycrystalline regions stabilize, and twinned structures emerge as dominant end states. The latent space representation also identifies amorphous patterns with weak
symmetry signatures that precede recrystallization. This reveals structural precursors to ordering that are not captured by conventional descriptors give new insights into how recrystallization is initiated.
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Quantum Gases
Momentum Distribution of a mass-imbalanced three-body system across the Efimov-Unatomic transition
D. S. Rosa, R. M. Francisco, T. Frederico et al. (+2 more)
We investigate the single-particle momentum distribution, the two-body contact and three-body tail coefficients of mass-imbalanced three-body systems at the critical dimension $D_c$, where the transition between discrete and continuous scale invariance takes place as the spatial dimension is tuned between three and two dimensions. We show that the asymptotic momentum distribution at $D_c$ is governed by a distinct logarithmic scaling structure, which differs fundamentally from both the log-periodic behavior of Efimov states and the power-law scaling of the unatomic regime. This structure contains an additional quadratic-logarithmic contribution, characterized by the asymptotic coefficient $C_3''$, which leads to a finite and well-defined description of the momentum tail at the transition. The coefficient $C_3''$ depends sensitively on the mass imbalance, changing sign across different mass configurations and vanishing for identical particles. For heavy-light-light configurations, the subleading three-body term vanishes at a characteristic momentum, leaving the leading two-body contribution at the order retained in the asymptotic expansion. The physical accessibility of this cancellation depends on the separation between the trimer size and the interaction range. We further analyze the narrow intermediate region connecting the Efimov and unatomic regimes, here identified as an intermediate scaling regime, whose extent and properties are strongly controlled by the mass ratio. These results establish the critical dimension as a regime with emergent scaling properties and provide quantitative momentum-space signatures for probing the transition between discrete and continuous scale invariance in few-body
quantum systems.
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All authors D. S. Rosa, R. M. Francisco, T. Frederico, G. Krein, M. T. Yamashita
Mesoscale and Nanoscale Physics
Aharonov-Casher-induced electric quadrupole of charge-neutral particles
Hojun Lee, Youngjae Jeon, Suik Cheon et al. (+1 more)
For charged particles, their orbital angular momentum (OAM) in solid have a direct
magnetic manifestation as an orbital magnetization. For charge-neutral particles, however, the physical manifestation of the OAM in solid remains unclear. Here, we show that a charge-neutral particle carrying a
magnetic moment couples to electric-field gradient through the Aharonov-Casher (AC) effect, thereby exhibiting the electric quadrupole in crystalline solids. This AC-induced electric quadrupole (AC-EQ) contains the scalar, toroidal dipole, and reduced quadrupole components, which are conjugate to the divergence, circulation, and shear of the electric field, respectively. As representative examples, we calculate the AC-EQ of
magnons in two
magnetic systems. In
ferromagnetic pyrochlore, Dzyaloshinskii-Moriya interaction (DMI) induces a sizable AC-EQ, whereas in helical Fe langasite the AC-EQ emerges from the helical
spin configuration even in the absence of DMI.
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All authors Hojun Lee, Youngjae Jeon, Suik Cheon, Hyun-Woo Lee
Soft Condensed Matter
Microscopic constitutive theory of stress overshoot, yielding, and strain hardening in amorphous materials
Ankit Singh, Valeriy V. Ginzburg and Alessio Zaccone
We develop a microscopic constitutive theory for the nonlinear deformation of metallic and
polymer glasses based on nonaffine elasticity coupled to irreversible many-body relaxation. The theory predicts the full stress–strain response, from linear elasticity through stress overshoot and yielding to steady plastic flow. We show that stress overshoot originates from the competition between a nonaffine elastic instability induced by strain-driven loss of mechanical connectivity at the atomic/molecular level, and viscous dissipation associated with structural relaxation. For
polymer glasses, finite chain extensibility naturally accounts for strain hardening at large deformation. The stretched-exponential relaxation exponent is obtained independently from stress or modulus relaxation measurements and provides the primary dynamical input to the theory. Using a small set of physically meaningful parameters, the model quantitatively reproduces experimental stress–strain curves for metallic glasses, polycarbonate, PMMA, and epoxy resins over a broad range of strain rates. These results establish a unified microscopic framework linking relaxation dynamics, yielding, plastic flow, and strain hardening in amorphous solids.
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Materials Science · Cross-listed from cs.LG
Microstructure-Conditioned Surrogate Models for Graded Multiscale Optimization of Mycelium Composites
J. Storm, I.B.C.M. Rocha, S. Schyck et al. (+2 more)
Emerging sustainable materials increasingly rely on engineered hierarchy and microstructure to achieve control of their properties and mechanical behavior. Optimizing these materials with controllable microstructures requires efficient multiscale simulations. Data-driven surrogate models for the microscale can accelerate multiscale simulations, but require large amounts of data even for a fixed microstructure. When a range of microstructures is considered, as is the case in multiscale optimization, even more data is needed to train a surrogate. To overcome this challenge, we condition a hybrid physics-data surrogate on microstructural variables using a hypernetwork. This approach enables accurate predictions of multiscale mechanical behavior for a mycelium-woodchip composite material, even when trained on small
datasets. The conditioned surrogate makes multiscale simulations of functionally graded structures tractable, and we validate it against a full FE^2 simulation. We optimize a graded multiscale disk, and reduce the peak stress by 43% compared to one with a random microstructure. Then, we go one step further, conditioning the network directly on manufacturing variables that can have a complex influence on the microstructure. This is a practical route to engineer the microscale for desired macroscale behavior. This contribution highlights the benefits of microarchitectured structures and demonstrates how conditioned surrogate models enable their multiscale optimization, which will accelerate the development and design of future sustainable materials and structures.
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All authors J. Storm, I.B.C.M. Rocha, S. Schyck, K. Masania, F.P. van der Meer
Strongly Correlated Electrons
Magnetic quadrupole current generation and accumulation in noncentrosymmetric systems
Yuuga Takasu and Satoru Hayami
Magnetization control via
magnetic octupole injection has recently been proposed for a new class of centrosymmetric antiferromagnets, namely $d$-wave altermagnets, where the
magnetic octupole is the lowest-rank
magnetic multipole allowed by
symmetry and serves as an alternative carrier to
spin injection. In contrast, in noncentrosymmetric antiferromagnets, the
magnetic quadrupole (MQ) constitutes the lowest-rank
symmetry-allowed
magnetic multipole, suggesting that MQ currents can provide an efficient route toward magnetization control through MQ injection. Here, we establish the
symmetry conditions for MQ-current generation by constructing the multipole representation of the MQ conductivity tensor and show that MQ currents are generically allowed in noncentrosymmetric crystallographic point groups. As a representative example, we demonstrate MQ-current generation in the linear-response regime associated with
symmetry lowering from the centrosymmetric point group ($mmm$) to its noncentrosymmetric subgroup ($mm2$). Furthermore, we reveal MQ accumulation near sample edges, analogous to
spin accumulation induced by the
spin Hall effect. This edge accumulation provides direct evidence of MQ-current generation and constitutes a key prerequisite for realizing MQ injection and MQ-based magnetization control in noncentrosymmetric antiferromagnets.
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Strongly Correlated Electrons
Stoner transitions beyond mean-field in two-dimensional electronic systems: a diagrammatic Monte Carlo study
Yueh-Chen Lee, Nikolay V. Prokof'ev and Andrey V. Chubukov
Stoner instabilities for
fermions with repulsive interaction have been well studied within the mean-field (ladder) approximation. In this study, we consider two-dimensional electronic systems with one or two valleys and discuss a Stoner transition beyond the ladder approximation. At weak coupling, the corrections to the ladder approximation come predominantly from the renormalization of the particle-hole vertex in the particle-particle channel, and the lowest-order corrections are logarithmically singular in the low-density limit. To investigate the problem beyond the lowest order, we apply the diagrammatic Monte Carlo
algorithm and treat ladder and non-ladder renormalizations on equal footing. We find that in a one-valley system, a Stoner transition to a ferromagnetism occurs at low density only if there is a cutoff on the momentum transfer carried by the interaction. In a two-valley system, the restriction is less severe. Here we find either a direct Stoner transition into a
spin- and valley-polarized state, or a set of two Stoner transitions via an intermediate valley-polarized state. The pathway is controlled by the anisotropy of the fermionic dispersion.
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Superconductivity
Direct observation of photon-induced vortices in superconducting films
Takeshi Jodoi, Fuminori Hirayama, Tetsuya Tsuruta et al. (+2 more)
Nucleation of
vortex-antivortex pairs (VAPs) is believed to play a central role in the
photon detection mechanism of superconducting detectors; however, their direct dynamic observation has remained challenging. Here, we report the direct observation of
photon-induced VAP dynamics in a current-carrying
superconductor as quantized voltage signals following
photon absorption. The observed signals are interpreted as discrete phase-slip events, where each
vortex traversal induces a 2-pi phase change of the superconducting order parameter, resulting in a quantized voltage pulse whose time integral is given by the
magnetic flux
quantum. We analyze the resulting quantized signals as a function of bias current, base temperature, and input
photon-number states, and find that the number of VAPs generated per absorbed
photon becomes effectively stabilized under specific conditions. Under these conditions, we demonstrate
photon-number-resolving capability by directly counting phase-slip-induced voltage quanta. Our results reveal a detection mechanism governed by phase dynamics rather than conventional resistive transitions. We further show that
photon-number resolution emerges when the fluctuation of
photon-induced
vortex-antivortex pair generation becomes statistically suppressed. These findings establish a new route toward
photon-number-resolving detection based on phase-slip counting and open opportunities for high-speed superconducting detectors for
quantum optics and photonic
quantum technologies.
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All authors Takeshi Jodoi, Fuminori Hirayama, Tetsuya Tsuruta, Takahiro Kikuchi, Daiji Fukuda
Materials Science
Role of small-radius and high-electronegativity A-Site dopants in enhancing proton transport and stability of perovskite electrolytes
Hang Ma, Ying Liang and Tianxing Ma
The practical application of BaCeO$_3$-based electrolytes is limited by their poor chemical stability in
proton-conducting solid
oxide fuel
cells. Commonly employed B-site doping strategies typically improve
proton transport with limited improvement in stability. Recent experiments show that A-site Ca doping can simultaneously enhance both properties. Here, through first-principles calculations and mechanistic analysis of Ca-doped BaCeO$_3$, we identify the synergistic roles of small-radius, high-electronegativity A-site dopants in governing
proton transport and chemical stability in perovskite electrolytes. We show that the higher electronegativity of A-site dopant weakens the A-O ionic bonding, facilitating oxygen-vacancy formation and enhancing
proton uptake by increasing the basicity. This weakened A-O interaction also suppresses the formation of
impurity phases and reduces the adsorption strength of acidic gases such as CO$_2$ and SO$_2$. The
lattice contraction induced by the smaller ionic radius improves thermal stability and can enhance
proton diffusion in systems where
proton transfer is the rate-limiting step. Furthermore, we find that Ca surface segregation can mitigate grain-boundary resistance effects. Our results demonstrate the advantages of A-site Ca doping in Ba-based electrolytes, clarify the mechanisms by which small-radius, high-electronegativity dopants influence
proton transport and chemical stability, and provide guidance for the design of high-performance
proton-conducting electrolytes.
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Strongly Correlated Electrons
Transverse order and longitudinal fluctuations in a near-Ising spin supersolid
Mengze Zhu, V. Romerio, S. Raymond et al. (+9 more)
We investigate the polarization of the ordered moments and low-energy
spin fluctuations in the
spin supersolid state of the S = 1/2 triangular-
lattice easy-axis antiferromagnet K2Co(SeO3)2 using
neutron scattering. The supersolid order develops through successive BKT transitions: the longitudinal order appears at higher temperature, while the transverse component associated with the Bose-Einstein condensate emerges only below a lower-temperature transition accompanied by a change in the interlayer correlations. At the lowest measured temperature, the transverse ordered moment reaches only 11% of the longitudinal component. Moreover, the low-energy
spin fluctuations are found to be predominantly longitudinal in character. These results provide direct evidence that the supersolid ground state survives even in the near-Ising regime and exhibits longitudinal low-energy dynamics, imposing stringent constraints on microscopic theories of triangular-
lattice XXZ antiferromagnets.
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All authors Mengze Zhu, V. Romerio, S. Raymond, N. Murai, S. Ohira-Kawamura, K. Yu. Povarov, S. A. Zvyagin, R. Sibille, A. Minelli, Z. Yan, S. Gvasaliya, A. Zheludev
Materials Science
Research progress in high-pressure tuning of layered magnetic materials
Yue Dongdong, Gao Xin, Mu Congpu et al. (+2 more)
Two-dimensional van der Waals materials have enormous potential applications in many fields due to their unique layered structure and excellent properties. Compared with three-dimensional bulk materials, layered systems are coupled by weak van der Waals interactions between layers, endowing them with much higher structural compressibility, particularly along the interlayer direction, which is more sensitive to external pressure. High pressure can expand the accessible phase space, enabling the synthesis of new materials or the retention of metastable phases. On the microscopic level, pressure can significantly tune the interlayer structure and interactions, induce changes in the electronic structure, and consequently give rise to a variety of rich physical properties. This article systematically introduces in situ high-pressure experimental approaches, including diamond anvil
cells combined with X-ray and spectroscopic techniques, high-pressure
magnetic transport measurements, and emerging NV-center
quantum sensing. It further reviews representative pressure-induced phenomena and underlying tuning mechanisms in layered
magnetic materials, such as high-
spin to low-
spin transitions of transition-metal ions and the accompanying structural phase transitions and superconductivity; substantial enhancement of the Curie temperature and continuous switching of magnetocrystalline anisotropy; and
antiferromagnetic-to-
ferromagnetic transitions achieved by modulating exchange interactions or via stacking engineering. Finally, we discuss future directions, including synergistic multi-field control by combining pressure with electric fields and twisted
heterostructures, as well as strategies such as pressure quenching to retain high-pressure metastable
magnetic phases at ambient conditions.
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All authors Yue Dongdong, Gao Xin, Mu Congpu, Liu Zhongyuan, Zhai Kun
Quantum Gases
Phase diagram of one-dimensional bosons with Rydberg-dressed soft-core interactions
Shengjie Yu and Laurent Sanchez-Palencia
Rydberg and Rydberg-dressed atomic gases have recently emerged as a promising
quantum simulator for a variety of models in condensed matter physics. Here we investigate one-dimensional
bosons with soft-core Rydberg-dressed interactions using exact path-integral
quantum Monte Carlo simulations. The finite-range and the negative
Fourier component of the interaction potential generate a roton mode at finite momentum, while particle-hole backscattering processes enhance the susceptibility of one-dimensional systems at twice the
Fermi momentum. The competition between the corresponding length scales yields a rich phase diagram, featuring a conventional Tomonaga-Luttinger
liquid (TLL) regime, a beyond-TLL regime, and commensurate cluster phases. In the TLL regime, the system transitions from Lieb-Liniger-like bnehavior with Luttinger parameter $K>1$ to hard-rod-like behavior with $K<1$, with a quasi-supersolid phase emerging for $K < 1/2$. For strong interactions and high densities, deviations from TLL theory appear as precursors for the onset of cluster phases, where particles aggregate into stable clusters of several particles. The properties of each phase is discussed in detail.
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Statistical Mechanics
Opinion Formation in a Spatially Constrained Coevolving Nonlinear Voter Model
Phil Gwon Kim, Jaeyong Bae, Jaeseok Hur et al. (+1 more)
We investigate a spatially constrained coevolving nonlinear voter model. Using a random
geometric graph, we constrain the interaction range of voter dynamics. If local rewiring is not possible, the discordant link is deleted. Our results reveal absorbing states that differ not only in magnetization and activity, but also in mean degree and spatial state organization. By exploring dynamical and structural observables, we found that distinct regimes from the existing coevolving nonlinear voter model are characterized by a reduced consensus region, spatially segregated fragmentation, and isolated node formation. Additionally, we develop a phenomenological description of the
evolution of the mean degree and terminal non-conserved quantities that is consistent with the numerical results. Our model highlights how local
geometric accessibility reshapes the structure of the absorbing states.
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All authors Phil Gwon Kim, Jaeyong Bae, Jaeseok Hur, Hawoong Jeong
Materials Science
Rotation topological states: theory and material realization
Chun-Xue Liu, Yilin Han, Runze Li et al. (+2 more)
The conventional characterization of topological materials relies on topological invariants calculated from the entire set of occupied bands. However, when a system possesses rotational
symmetry, the occupied
Hilbert space can be decomposed into multiple subspaces labeled by distinct rotation
eigenvalues. We show that this decomposition reveals hidden topological states characterized by a novel $\mathbb{Z}_2^n$ topological invariant, where $n$ is the number of subspaces, while the conventional $\mathbb{Z}_2$ invariant may fail to detect the
topology hidden in the rotation subspaces. Remarkably, time-reversal
symmetry pairs conjugate rotation
eigenvalues and guarantees that the two subspaces have the same $\mathbb{Z}_2$ invariants, making the
topology always hidden from the conventional global invariant. We formulate the theory of rotation-subspace
topology and demonstrate its material realization in bulk CsCl. Using first-principles calculations and
symmetry analysis, we show that bulk CsCl, which is diagnosed as topologically trivial by the conventional approach, features a nontrivial $\mathbb{Z}_2^3$ invariant along the $\Gamma$-R path and a nontrivial $\mathbb{Z}_2^4$ invariant along the $\Gamma$-Z and M-R paths, leading to double Weyl points on the (111) and (001) surfaces, respectively. The subspace $\mathbb{Z}_2^n$ invariant proposed here serves as a necessary refinement for
symmetry-protected topological phases and will facilitate the identification of a large class of topological states overlooked by existing diagnostics.
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All authors Chun-Xue Liu, Yilin Han, Runze Li, Yulong Liu, Zhi-Ming Yu
Strongly Correlated Electrons
Quantum-classical crossover in finite spin-1/2 rings with Dzyaloshinsky-Moriya interaction
Raúl Sánchez Galán and Robert Wieser
We study finite
spin-$\tfrac12$ rings with nearest-neighbor Heisenberg exchange, Dzyaloshinsky–Moriya interaction, and an external
magnetic field. We introduce an interpolation parameter between the fully
quantum Hamiltonian and a state-dependent mean-field description. Using dissipative Gisin–Schrödinger dynamics, we analyze the resulting
quantum–classical crossover through local magnetization, connected
spin correlations, single-site
entropy, and the saturation field of the fully polarized state.
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Mesoscale and Nanoscale Physics
Emergent induction in magnetic Weyl semimetals
Takahiro Anan and Takahiro Morimoto
We theoretically study emergent electromagnetic responses in Weyl semimetals. Focusing on
magnetic Weyl semimetals, we develop a general theory of emergent induction driven by
magnetic dynamics. We show that magnetoelectric (ME) responses in Weyl semimetals give rise to emergent induction mediated by magnetization dynamics. Using effective two-band models for
magnetic Weyl semimetals, we derive a formula for the ME response that includes both intraband and interband contributions. The resulting formula shows that the intraband contribution is proportional to the relaxation time $\tau$, whereas the interband contribution is associated with the separation of the Weyl nodes. Applying the general formula to a model of polar Weyl ferromagnets, we demonstrate that the dynamics of the toroidal moment is closely related to the emergent inductive response in polar Weyl ferromagnets, as recently discovered by Suzuki et al. [Y. Suzuki et al. arXiv:2607.12322]. The chemical-potential dependence of the inductance indicates that the emergent electromagnetic response is enhanced in the energy range of the Weyl dispersion, reflecting the topological nature of Weyl semimetals.
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Materials Science · Cross-listed from physics.optics
Imprinting topology on thermal light
Tianle Chen, Kelsey Everts, Andrew Forbes et al. (+1 more)
Topological structuring of light inevitably leverages on optical coherence to ensure that the imparted spatial phases are preserved, requiring highly coherent sources or coherence engineering embedded in the design. Now we show that thermal light can be spatially engineered to carry optical
topologies in the form of Skyrmions. Such
topologies are immune to time averaged decoherence, a fact we leverage on in reverse to create metasurface mediated incoherent
topologies from a thermal source. The pristine nature of our measured Skyrmions validates the approach, while simulations reveal how coherence management in the metasurface design would further enhance the functionality. Remarkably, the generation stage inherits robustness from the
topology, remaining immune to material and fabrication defects. Our work reports the first
topologies from purely thermal light, opening a path to exploiting
topology in ubiquitous everyday light sources.
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All authors Tianle Chen, Kelsey Everts, Andrew Forbes, Yungui Ma
Materials Science
Hybridization-controlled re-entrant electronic phase switching and moire-confined states in twisted bilayer PtTe2
Seoung-Hun Kang, Jeonghwan Ahn and Young-Kyun Kwon
Twisting a van der Waals
bilayer changes not only the moiré periodicity but also the local stacking and interlayer hybridization. Here, we show, using fully relaxed first-principles calculations including
spin–orbit coupling, band unfolding, and Brillouin-zone-integrated densities of states, that
bilayer PtTe$_2$ exhibits a non-monotonic
evolution between gapless and gapped electronic regimes. The $7.34^\circ$ structure remains gapless, whereas finite direct gaps appear at the sampled intermediate angles. The gap closes at the sampled $60^\circ$ configuration and reopens at higher angles. The direct gap shows an overall increase with the minimum local interlayer Pt–Pt separation, although the complete distribution of local stacking environments is required to account for deviations from this trend. At $7.34^\circ$, the low-energy states are concentrated predominantly in the AA-like regions of the otherwise gapless moiré
cell. Controlled interlayer-separation scans show that increasing the layer spacing removes the near-$E_F$ crossings and opens a gap, consistent with weakened interlayer Te-$p_z$ hybridization. These results identify the redistribution of interlayer hybridization as the microscopic origin of the re-entrant gap
evolution in twisted
bilayer PtTe$_2$.
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Materials Science
Physics-Informed Residual Deep Learning for Constitutive Modeling of Hot Deformation and Dynamic Recrystallization in a Mo-Rich $\alpha+\beta$ Titanium Alloy
Prashil S. Joshi, Diksha Mahadule and Rajesh K.Khatirkar
Accurate constitutive modeling of hot deformation behavior is essential for designing thermomechanical processes in advanced structural
alloys. Conventional Arrhenius-type and empirical models do not adequately capture the combined effects of strain hardening, dynamic recovery (DRV), and dynamic recrystallization (DRX) across broad processing conditions. In this study, two Stacked Residual Physics-Informed Neural Networks (
STAR-PINNs) were developed to simulate the hot deformation response of a Mo-rich $\alpha+\beta$ titanium
alloy (Ti-6Al-4Mo-1V-0.1Si). The Enhanced
STAR-PINN incorporated thermomechanical constitutive constraints, while the DRX-Aware
STAR-PINN employed a dual-output architecture to account for recrystallization kinetics. Both models used a shared residual encoder trained on experimental flow stress data collected at temperatures from 800 to 1050 degrees C and strain rates between 0.01 and 10 per second. Physics-informed constraints, including thermal softening, strain-rate sensitivity, strain hardening, and post-peak softening, were enforced through automatic differentiation. The DRX-Aware model further integrated JMAK-Avrami regularization, DRX saturation constraints, and Arrhenius-based consistency with tunable parameters, directly linking the predicted DRX fraction to stress output via latent-feature fusion. The DRX-Aware
STAR-PINN achieved RMSE = 11.62 MPa, MAE = 4.73 MPa, R^2 = 0.9852, and a cross-validated RMSE of 12.74 +/- 0.38 MPa. The learned JMAK parameters converged to k = 2.03 and n = 1.99, remaining close to the conventional values while being inferred directly from the data. The model effectively mirrored flow curves influenced by temperature, DRX development, and Zener Hollomon correlations under interpolation scenarios while preserving physically coherent constitutive behavior.
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Mesoscale and Nanoscale Physics · Cross-listed from quant-ph
Deterministic single-electron trapping on solid neon using engineered dielectric surface geometry
Kundan Surse, Eric Helgemo, Andrew Palmer et al. (+5 more)
Levitating electron
qubit on the surface of solid neon has recently emerged as a promising and intrinsically noise-resilient platform for
quantum information processing. Their ultra-clean, inert environment suppresses conventional decoherence pathways associated with
lattice disorder, charge traps, and
nuclear-
spin baths that limit coherence in
semiconductor qubits. Yet, uncontrolled surface features such as bumps, valleys, and electrode-defined gaps can bind electrons unintentionally, contributing charge noise and inducing
spin-orbit coupling mediated decoherence. To address this challenge, we propose an engineered interface in which a dielectric layer is deposited beneath the solid neon to provide an atomically smooth template, eliminating surface-roughness induced trapping. By selectively etching this dielectric layer at desired
qubit locations, deterministic potential minima can be engineered to reliably capture electrons while suppressing unwanted surface bound states. We perform large-scale Schrodinger and Poisson simulation to compare the existing and proposed strategies of electron trapping on neon, obtaining good agreement with recent experimental measurements.
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All authors Kundan Surse, Eric Helgemo, Andrew Palmer, Md Serajum Monir, Lukas Delventhal, Thanh Nguyen, Maja Cassidy, Rajib Rahman
Strongly Correlated Electrons
Hubbard-assisted stability of Hatsugai-Kohmoto correlations in a one-dimensional open chain
Yan-Xiao Wang and Yin Zhong
The Hatsugai-Kohmoto (HK) model has recently been identified as a fixed-point description of Mottness that is stable against perturbing local interactions. This raises a natural question beyond the weak-perturbation regime: how does a finite local repulsion modify HK physics in real-space observables and local spectra? We address this question in a half-filled one-dimensional spinful
fermion chain, where the HK interaction is supplemented by an onsite Hubbard repulsion. Using exact diagonalization in an open chain, we compute ground-state correlation functions and site-resolved local spectra. We find that the Hubbard term does not drive the system away from the HK-dominated regime. Instead, at moderate $U_{\rm HK}$, a finite $U_{\rm Hub}$ promotes the emergence of behavior characteristic of the pure HK chain at larger $U_{\rm HK}$. This Hubbard-assisted strong-HK response is reflected consistently in the development of positive
spin correlations, the suppression of single-particle coherence, the
impurity-induced redistribution of local spectral weight, and the
evolution of pairing correlations. As a control perturbation, we replace the onsite Hubbard interaction by a nearest-neighbor (NN) density interaction. In contrast to the Hubbard case, the HK and NN interactions display competing tendencies and do not reproduce the same strong-HK behavior. These results provide a nonperturbative real-space complement to the fixed-point stability of HK physics and show that the effect of an additional repulsive interaction depends sensitively on its spatial structure.
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Materials Science
Resistivity in Dilute Cu-3d Alloys Governed by Disorder-Induced Band Broadening
Kenji Yamaguchi
The mechanism governing the resistivity in dilute Cu-3d transition-metal
alloys at ambient temperature – the regime relevant to most practical applications and distinct from the low-temperature, Kondo-screened regime addressed by earlier theoretical work – is investigated using first-principles calculations based on the Korringa–Kohn–Rostoker coherent potential approximation combined with the Kubo–Greenwood formalism. The paramagnetic state is described within the disordered local moment (DLM) framework, corresponding to a local-moment paramagnet rather than a Pauli paramagnet. We show that the experimentally observed resistivity trends are reproduced only within the DLM description, while nonmagnetic and
ferromagnetic states fail to capture the correct element dependence. Contrary to conventional interpretations based on the density of states at the
Fermi level, the resistivity exhibits a strong correlation with the full width at half maximum (FWHM) of the Bloch spectral function (BSF) on the
Fermi surface. This correlation reflects the disorder-induced lifetime broadening of electronic states, directly related to the scattering rate that governs electrical resistivity. A common power-law scaling between resistivity and BSF broadening is identified across different
magnetic states. These results demonstrate that the resistivity is governed by disorder-induced band broadening in momentum space rather than by local density-of-states effects, providing a unified microscopic interpretation of the breakdown of Linde's rule in Cu-based
alloys.
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Strongly Correlated Electrons
Dirac topology, anomalous Hall response, and giant magnetoresistance in carrier-compensated altermagnetic semimetal NiS
Shovan Gayen, Sk. Soyeb Ali and S K Panda
We combine first-principles density-functional theory, Berry-
curvature analysis, semiclassical Boltzmann transport, and atomistic
spin dynamics to establish hexagonal NiS as a compensated 3d altermagnetic semimetal in which
topology, magnetism, and
lattice dynamics are intrinsically intertwined. The rotational coset
symmetry of the NiAs
lattice produces momentum-dependent
spin splitting characteristic of altermagnetism. With
spin-orbit coupling, gapped Dirac-like crossings generate intense Berry-
curvature hot spots and nearly compensated electron-hole pockets. This leads to a large and anisotropic intrinsic
spin Hall conductivity comparable to that of several 4d, 5d metals, a
symmetry-allowed anomalous
Hall response despite zero net magnetization, and nonsaturating magnetoresistance exceeding 10000 percent. On the
magnetic side, first-principles determination of the exchange tensor reveals dominant long-range superexchange and sizable anisotropic interactions, quantitatively reproducing the experimental Neel temperature. Our results identify NiS as a model 3d platform in which carrier compensation, altermagnetic
symmetry, Berry-
curvature driven transport, and
lattice-sensitive magnetism coexist within a single
symmetry framework, offering a design principle for multi-functional
quantum responses in correlated transition-metal compounds.
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