Showing 1–50 of 971 results for author: Chen, Z

Spin Vector Control for Heisenberg-Inspired Probabilistic Computing

Authors: Yuanqiu Tan, Rahul Tripathi, Saleh Bunaiyan, Ryan Wagner, Neil Dilley, Kerem Camsari, Joerg Appenzeller, Zhihong Chen

Abstract: Probabilistic bits (p-bits) have emerged as a cornerstone of probabilistic computing, enabling energy-efficient hardware implementation for probabilistic inference and combinatorial optimization. A critical challenge in advancing this field beyond binary p-bits lies in realizing and manipulating vector spin information, essential for mapping complex energy-based models such as the Heisenberg Hamil… ▽ More Probabilistic bits (p-bits) have emerged as a cornerstone of probabilistic computing, enabling energy-efficient hardware implementation for probabilistic inference and combinatorial optimization. A critical challenge in advancing this field beyond binary p-bits lies in realizing and manipulating vector spin information, essential for mapping complex energy-based models such as the Heisenberg Hamiltonian.Here, we demonstrate a spintronic platform capable of real-space vector summation by using dual ferromagnetic spin injections into a monolayer graphene channel. By electrically tuning the spin polarization through independently controlled injection currents, we achieve continuous control over the magnitude and direction of the resulting spin accumulation vector. Experimental observations, supported by theoretical vector summation models and spin-circuit simulations, reveal coherent vector interactions and angular tunability of the spin state. This approach enables direct implementation of vector-based spin logic and lays the groundwork for mapping classical Heisenberg models using stochastic low-barrier magnets. Our results establish a scalable pathway for realizing probabilistic spin circuits based on two-dimensional materials, offering new opportunities for low-power, non-Boolean computing architectures. △ Less

Submitted 12 August, 2026; originally announced August 2026.

Comments: 37 pages, 11 figures, 1 table

Using Deposition Rate and Substrate Temperature to Manipulate Liquid Crystal-like Order in a Vapor-deposited Hexagonal Columnar Glass

Authors: Camille Bishop, Zhenxuan Chen, Michael F. Toney, Harald Bock, Lian Yu, M. D. Ediger

Abstract: We investigate vapor-deposited glasses of a phenanthroperylene-ester, known to form an equilibrium hexagonal columnar phase, and show that liquid crystal-like order can be manipulated by the choice of deposition rate and substrate temperature during deposition. We find that rate-temperature superposition (RTS), the equivalence of lowering deposition rate and raising substrate temperature, can be u… ▽ More We investigate vapor-deposited glasses of a phenanthroperylene-ester, known to form an equilibrium hexagonal columnar phase, and show that liquid crystal-like order can be manipulated by the choice of deposition rate and substrate temperature during deposition. We find that rate-temperature superposition (RTS), the equivalence of lowering deposition rate and raising substrate temperature, can be used to predict and control the molecular orientation in vapor-deposited glasses over a wide range of substrate temperatures (0.75Tg to 1.0Tg). This work extends RTS to a new structural motif, hexagonal columnar liquid crystal order, which is being explored for organic electronics applications. By several metrics, including the apparent average face-to-face nearest-neighbor distance, PVD glasses of the phenanthroperylene-ester are as ordered as the glass prepared by cooling the equilibrium liquid crystal. By other measures, the PVD glasses are less ordered than the cooled liquid crystal. We explain the difference in the maximum attainable order with the existence of a gradient in molecular mobility at the free surface of a liquid crystal, and its impact upon different mechanisms of structural rearrangement. This free surface equilibration mechanism explains the success of the RTS principle and provides guidance regarding the types of order most readily enhanced by vapor deposition. This work extends the applicability of RTS to include molecular systems with a diverse range of higher-order liquid crystalline morphologies that could be useful for new organic electronic applications. △ Less

Submitted 11 August, 2026; originally announced August 2026.

Comments: 33 pages, 4 figures, 46 references; Supplemental information with 9 figures

Journal ref: J. Phys. Chem. B 2021, 125, 2761-2770

Observation geometry for uncertainty-aware Hamiltonian inference and experimental design in quantum magnets

Authors: Roy Liu, Venugopal Ranganathan, David Dahlbom, Shizhou Xu, Tianyu Zhang, Yuan Ni, Daniel M. Pajerowski, Garrett Granroth, Thomas Strohmer, Matthew B. Stone, Andrew F. May, Mark D. Lumsden, Joshua J. Turner, Yongqiang Cheng, Zhantao Chen

Abstract: Determining microscopic interactions from spectroscopic and scattering measurements is central to understanding quantum materials, yet it often remains unclear which interactions can be reliably revealed by the available experimental data and how additional experimental modalities should be designed to resolve the remaining ambiguities. Here we present an artificial intelligence-enabled framework… ▽ More Determining microscopic interactions from spectroscopic and scattering measurements is central to understanding quantum materials, yet it often remains unclear which interactions can be reliably revealed by the available experimental data and how additional experimental modalities should be designed to resolve the remaining ambiguities. Here we present an artificial intelligence-enabled framework for uncertainty-aware Hamiltonian inference and adaptive experimental design. By combining Hamiltonian-conditioned neural surrogates with Bayesian inference and observation geometry, the framework characterizes how measurements constrain Hamiltonian parameter space, quantifies the identifiability of microscopic interactions, and propagates posterior uncertainty directly in the physical Hamiltonian parameter space rather than an abstract learned representation. Using multimodal powder and single-crystal inelastic neutron scattering measurements of the quantum magnet NiPS$_{3}$, we demonstrate physically interpretable Hamiltonian inference, modality-aware uncertainty quantification, and adaptive experimental design. The framework provides a general strategy for uncertainty-aware microscopic characterization and multimodal experimental design across quantum materials. △ Less

Submitted 10 August, 2026; originally announced August 2026.

Hexagonal Stacking Maximizes Proton Configurational Entropy among Ice-I Polytypes

Authors: Zhengyue Chen, Sheng Ran

Abstract: Ice I admits cubic, hexagonal, and mixed layer stackings, but rigorous entropy comparisons have focused on the two ideal endmembers. We represent every cyclic uniform-registry stacking by a word in a nonnegative transfer operator K and its transpose. For every such even-length word, applying the Schatten-Hölder inequality proves that alternating hexagonal stacking maximizes the ice-rule count at e… ▽ More Ice I admits cubic, hexagonal, and mixed layer stackings, but rigorous entropy comparisons have focused on the two ideal endmembers. We represent every cyclic uniform-registry stacking by a word in a nonnegative transfer operator K and its transpose. For every such even-length word, applying the Schatten-Hölder inequality proves that alternating hexagonal stacking maximizes the ice-rule count at every common finite cross-section; the configuration constant is therefore maximal among all periodic uniform-registry polytypes. We obtain the lower endpoint by restricting Nagle's positive even-subgraph expansion to exactly enumerated disjoint blocks. Finner's degree-two hypergraph Hölder inequality and rational Collatz-Wielandt certificates for two-replica prism transfer operators give the upper endpoints. These constructions yield $1.503360 \le w \le 1.540196$, with $w(\mathrm{Ic}) \le 1.527699$. △ Less

Submitted 6 August, 2026; originally announced August 2026.

Comments: 14 pages, 4 figures. Supplemental Material included as appendices S1-S7

MSC Class: 82B20; 05C30; 15B48

CP2K: An electronic structure and molecular dynamics software package - Dynamics, Transport, and Spectroscopic Response

Authors: Jan Wilhelm, Anna-Sophia Hehn, Hossam Elgabarty, Beliz Sertcan Gökmen, Maximilian Graml, Stepan Marek, Ritaj Tyagi, Frederick Stein, Johann V. Potoschnig, Augustin Bussy, Christian S. Ahart, Zehua Chen, Linnea Andersson, Zdenek Futera, Filip Ivanovic, Margherita Buraschi, Christoph Schran, Remi Pasquier, Leonard Prokisch, Bibek Samal, Jelena Schmitz, Shridhar Sanjay Shanbhag, Harald Forbert, Ole Schütt, Franz Pöschl , et al. (17 additional authors not shown)

Abstract: One of the distinguishing aspects of CP2K is its seamless integration of diverse structural and transition-state optimization techniques with advanced sampling approaches including Monte Carlo, molecular dynamics, and metadynamics, enabling the efficient exploration of complex potential- and free-energy landscapes, including rare events. These capabilities are combined with a broad hierarchy of en… ▽ More One of the distinguishing aspects of CP2K is its seamless integration of diverse structural and transition-state optimization techniques with advanced sampling approaches including Monte Carlo, molecular dynamics, and metadynamics, enabling the efficient exploration of complex potential- and free-energy landscapes, including rare events. These capabilities are combined with a broad hierarchy of energy and force evaluation methods, ranging from classical and machine-learned interaction potentials and mixed quantum-classical multiscale and semiempirical schemes, to highly accurate quantum-mechanical electronic-structure approaches. At the heart of the latter lies the Gaussian and plane-wave framework, along with its augmented all-electron generalization, which have been described in detail in our previous code review [T. D. Kühne et al., J. Chem. Phys. 152, 194103 (2020)]. Building on this foundation, the present work revisits the methods within CP2K that turn electronic structure into dynamics, transport, and spectroscopic response. Particular emphasis is placed on the coupling between static response calculations and nuclear motion: spectra may be evaluated at optimized structures, averaged over thermally sampled configurations, obtained from time-correlation functions along ab-initio or path integral molecular trajectories, or followed in real time together with electronic and nuclear dynamics. The same modular structure also enables equilibrium and biased transport simulations, from Kubo-type linear response to open-boundary approaches under external potentials, highlighting CP2K's unique capability to unify quantum chemistry with quantum and statistical mechanics within a versatile, holistic simulation environment. △ Less

Submitted 30 July, 2026; v1 submitted 24 July, 2026; originally announced July 2026.

Marginal-Fermi-Liquid-like Behavior without Pseudogap in Infinite-Layer Nickelates

Authors: Yu Fan, Zhitong An, Xiang Ding, Xingtian Sun, Yutong Chen, Zhihui Chen, Shenglin Tang, Chihao Li, Jiahao Ye, Timur Kim, Haichao Xu, Rui Peng, Donglai Feng

Abstract: Pseudogap formation, strange-metal behavior and unconventional superconductivity are closely intertwined in hole-doped cuprates, yet their relationship remains unresolved. Infinite-layer nickelates offer a distinct 3d9-derived platform to address this question by combining a cuprate-like Ni dx2-y2 Fermi surface with multiband electronic degrees of freedom. Here we use angle-resolved photoemission… ▽ More Pseudogap formation, strange-metal behavior and unconventional superconductivity are closely intertwined in hole-doped cuprates, yet their relationship remains unresolved. Infinite-layer nickelates offer a distinct 3d9-derived platform to address this question by combining a cuprate-like Ni dx2-y2 Fermi surface with multiband electronic degrees of freedom. Here we use angle-resolved photoemission spectroscopy to resolve the low-energy spectral function of superconducting La0.8Ca0.2NiO2 and parent LaNiO2 thin films. In La0.8Ca0.2NiO2, the electronic self-energy Im Sigma(omega) is approximately linear in energy and its slope increases from (pi/2, pi/2) to (pi, 0), revealing momentum-dependent marginal-Fermi-liquid-like scattering. Both films show a progressive suppression of low-energy spectral weight from the diagonal direction toward (pi, 0), with stronger suppression in parent LaNiO2. However, finite Fermi-level spectral weight persists around the entire Fermi surface, with no leading-edge shift or back-bending indicative of pseudogap formation in either the electron pocket or the cuprate-like hole band. Our results demonstrate that momentum-selective correlations and marginal-Fermi-liquid-like scattering can occur without a detectable cuprate-like pseudogap, providing a benchmark for identifying the essential normal-state electronic ingredients of high-temperature superconductivity. △ Less

Submitted 18 July, 2026; originally announced July 2026.

Comments: 16 pages, 5 figures

A Disconnected Superconducting Regime at the Parent Limit of Infinite-Layer Nickelates

Authors: Chihao Li, Yutong Chen, Yaolong Bian, Yihao Zhang, Jiahao Ye, Zhitong An, Xingtian Sun, Yu Fan, Zhihui Chen, Zhanze Wang, Jinglei Zhang, Haichao Xu, Rui Peng, Donglai Feng

Abstract: Infinite-layer nickelates have been widely viewed as cuprate analogs in which superconductivity emerges and forms a superconducting dome centered around 10-20% cation substitution. Here we show that pristine and stoichiometric PrNiO2, without cation substitution, exhibits intrinsic superconductivity characterized by zero resistance and diamagnetism in uncapped films. Through heterostructure engine… ▽ More Infinite-layer nickelates have been widely viewed as cuprate analogs in which superconductivity emerges and forms a superconducting dome centered around 10-20% cation substitution. Here we show that pristine and stoichiometric PrNiO2, without cation substitution, exhibits intrinsic superconductivity characterized by zero resistance and diamagnetism in uncapped films. Through heterostructure engineering, we further exclude an interfacial origin of the superconductivity. Remarkably, zero-resistance superconductivity is consistently observed in trivalent-substituted PrNiO2, whereas it is rapidly suppressed by dilute divalent substitution. Combined with angle-resolved photoemission studies, these results indicate that such a new superconducting regime is confined to within 3% additional hole doping from pristine PrNiO2. Furthermore, this phase is separated from the previously established superconducting dome around ~ 20% divalent doping by a non-superconducting region in the phase diagram, and is further distinguished by a remarkably stronger upper-critical-field anisotropy. These findings establish a unique separated superconducting regime, suggesting that infinite-layer nickelates are not merely cuprate analogs but host distinct superconducting physics. △ Less

Submitted 18 July, 2026; originally announced July 2026.

Comments: 7 pages, 4 figures

MSC Class: 82D55

AIMS: an AI experimentalist turns uncertainty into quantum matter discovery

Authors: Siyuan Qiu, Philip D. Suh, Nhat Huy Tran, Xirui Wang, Heonjoon Park, Kutay Akin, Kevin K. S. Multani, Seungwon Jung, Wenkai Cai, Xinyu Liu, León Garcia, Ziyan Zhu, Chunjing Jia, Zhantao Chen, Zhixun Shen, Zhurun Ji

Abstract: Most AI agents act only after scientists have defined the task. Discovery is harder under practical uncertainties: the probe may not be where it is expected, the signal may occupy only a small region of a disordered sample, and the evidence may not distinguish among competing explanations. Here we show that an AI agent can decide what evidence an uncertain experiment needs next, and act on it. Bey… ▽ More Most AI agents act only after scientists have defined the task. Discovery is harder under practical uncertainties: the probe may not be where it is expected, the signal may occupy only a small region of a disordered sample, and the evidence may not distinguish among competing explanations. Here we show that an AI agent can decide what evidence an uncertain experiment needs next, and act on it. Beyond automation, AIMS, an uncertainty-aware experimentalist for cryogenic microwave impedance microscopy, quantifies uncertainty where it originates, in perception, sampling, and interpretation, and converts each into its own corrective action rather than a single confidence score. Given only an open objective, AIMS relocated a probe lost during cooldown while flagging its own unreliable estimates, mapped twist angle disorder to locate the strongest correlated states in twisted bilayer MoSe$_2$, and uncovered a paradox: the half-filled stripe that classical theory predicts should melt first survived longest. Distinguishing an incomplete model from a wrong mechanism, AIMS commissioned a beyond-mean-field calculation and an independent structural measurement as the decisive tests, revising its interpretation as each arrived: quantum motion reverses the classical hierarchy, stabilizing the half-filled stripe while destabilizing its neighbors. These uncertainty-to-action loops are generic to scanning probe experiments, and AIMS turns uncertainty from an obstacle into a driver of discovery. △ Less

Submitted 8 August, 2026; v1 submitted 17 July, 2026; originally announced July 2026.

Direct observation of anisotropic exciton dispersion in the 2D semiconductor CrSBr

Authors: Yiwen Song, Peiyi He, Weizhe Zhang, Wenyuan Ouyang, Wenjing Liu, Jinlong Du, Zuxin Chen, Jiuyu Sun, Peng Gao, Yu Ye

Abstract: We report momentum-resolved measurements of exciton dispersion in multilayer CrSBr using defocus-engineered electron energy-loss spectroscopy, supported by first-principles calculations. A pronounced in-plane anisotropy is observed, with the exciton exhibiting a linear dispersion along $Γ$Y within $\lvert \boldsymbol{q} \rvert$ < 0.007 Å$^{-1}$, while remaining nearly dispersionless along $Γ$X. Th… ▽ More We report momentum-resolved measurements of exciton dispersion in multilayer CrSBr using defocus-engineered electron energy-loss spectroscopy, supported by first-principles calculations. A pronounced in-plane anisotropy is observed, with the exciton exhibiting a linear dispersion along $Γ$Y within $\lvert \boldsymbol{q} \rvert$ < 0.007 Å$^{-1}$, while remaining nearly dispersionless along $Γ$X. The slope reaches 7.02 eV Å, among the largest reported in low-dimensional systems. The calculations reproduce the experimentally observed linear dispersion, confirming its intrinsic origin. We attribute the anisotropic dispersion to the long-range electron--hole exchange interaction, enhanced by strong out-of-plane confinement and governed by the directional selection rules of the transition dipole moment. Comparative measurements across the magnetic phase transition from the paramagnetic to the A-type antiferromagnetic state show that the dispersion remains essentially unchanged, indicating negligible coupling between exciton propagation and magnetic order. These results establish CrSBr as a model system for investigating anisotropic exciton dynamics in low-symmetry layered semiconductors. △ Less

Submitted 16 July, 2026; originally announced July 2026.

Comments: 6 pages, 3 figures

Precision quantum simulation of magnon spectra and interactions

Authors: Trond I. Andersen, Nikita Astrakhantsev, Jeronimo Martinez, Will Morong, Johannes Motruk, Dario Rossi, Brayden Ware, Bryce Kobrin, Weijie Wu, Elizabeth Bennewitz, Manuel Rudolph, Tom Westerhout, Amira Abbas, Rajeev Acharya, Laleh Aghababaie Beni, Ross Alcaraz, Sayra Alcaraz, Markus Ansmann, Frank Arute, Kunal Arya, Walt Askew, Juan Atalaya, Christopher Ayala, Ryan Babbush, Brian Ballard , et al. (307 additional authors not shown)

Abstract: Quantum simulation promises to advance materials discovery by accurately simulating complex states of matter, their microscopic excitations, and macroscopic response functions. The central challenge in resolving the underlying interacting dynamics is to combine high-fidelity evolution with the sophisticated control necessary to manipulate individual quasi-particles in quantum many-body states. Her… ▽ More Quantum simulation promises to advance materials discovery by accurately simulating complex states of matter, their microscopic excitations, and macroscopic response functions. The central challenge in resolving the underlying interacting dynamics is to combine high-fidelity evolution with the sophisticated control necessary to manipulate individual quasi-particles in quantum many-body states. Here, we report on high-precision simulation of both linear and non-linear response functions in a 2D XY spin-1/2 magnet using an analog-digital superconducting processor of up to 97 qubits. By interleaving digital gates with analog evolution precisely characterized via Hamiltonian learning, we selectively excite magnons at tunable energy densities. Measuring first the linear magnon response -- a central probe in neutron-scattering experiments -- we extract temperature-dependent spectra and lifetimes. Our results reveal stark variations in magnon decay rates across the Brillouin zone, with enhancement near van Hove singularities and suppression for edge-localized modes. Next, we perform a suite of nonlinear measurements, including the study of self-scattering mechanisms, as well as pump-probe spectroscopy to directly characterize the magnon interactions. While matrix-product state simulations capture the dynamics well in either small systems or at low temperatures, their predictions become inaccurate away from these limits. This work demonstrates precise simulation of the interacting dynamics in quantum magnets, and provides key insights into quasi-particles and their microscopic scattering mechanisms. △ Less

Submitted 14 July, 2026; originally announced July 2026.

Reproducible Reservoir Computing with Thermally Driven Superparamagnets: Controlling Temperature Sensitivity

Authors: Zhengfei Chen, Alex Welbourne, Matthew O. A. Ellis, Dan A. Allwood, Eleni Vasilaki, Thomas J. Hayward

Abstract: Unconventional computing systems must demonstrate robust performance under real-world environmental conditions to enable practical deployments. We have recently proposed superparamagnetic nanodot ensembles driven by strain-induced magnetoelectric coupling as exciting candidates for use as ultra-low energy consumption reservoir computing substrates. However, because their dynamics are governed by t… ▽ More Unconventional computing systems must demonstrate robust performance under real-world environmental conditions to enable practical deployments. We have recently proposed superparamagnetic nanodot ensembles driven by strain-induced magnetoelectric coupling as exciting candidates for use as ultra-low energy consumption reservoir computing substrates. However, because their dynamics are governed by thermal activation effects, these systems are intrinsically sensitive to ambient temperature fluctuations, leading to degraded task performance when operated outside the temperature range used during training. In this paper we simulate how temperature variations affect the magnetization dynamics of such superparamagnetic ensembles, and quantify how this affects task performance. We then show how heterogeneous nanodot patterns that incorporate different sizes of nanodots with different characteristic timescales for thermal activation mitigate this problem. Benchmark results on the NARMA-10 task show that introducing optimized heterogeneity stabilizes performance of the reservoirs across a wide range of ambient temperatures (5-35°C), with little loss of ultimate performance. We also characterize the trade-off between performance and temperature stability and show that it can be tuned via reservoir hyperparameters. Our study demonstrates a key step in making these novel devices suitable for real-world deployment. △ Less

Submitted 14 July, 2026; originally announced July 2026.

Comments: 19 pages, 6 figures and 4 tables. supplementary information included in the same PDF

Superconducting dome and field-enhanced superconductivity of PLD synthesized Nd1-xEuxNiO2 thin films

Authors: Wenlong Yang, Qiang Zhao, Xingke Fu, Gaofei Ren, Zhongjing Wu, Zhen Chen, Jianping Sun, Boseng Wang, Jiacai Nie, Pengtao Yang, Jinguang Cheng

Abstract: We report on the synthesis of infinite-layer Nd1-xEuxNiO2 (0<x<0.7) thin films using pulsed laser deposition (PLD) followed by topotactic reduction with CaH2. Resistivity measurements on these films reveal a superconducting dome within the doping range 0.2<x<0.5, which is wider than that achieved by molecular beam epitaxy and comparable to that obtained by chemical synthesis. The x=0.3 PLD film ex… ▽ More We report on the synthesis of infinite-layer Nd1-xEuxNiO2 (0<x<0.7) thin films using pulsed laser deposition (PLD) followed by topotactic reduction with CaH2. Resistivity measurements on these films reveal a superconducting dome within the doping range 0.2<x<0.5, which is wider than that achieved by molecular beam epitaxy and comparable to that obtained by chemical synthesis. The x=0.3 PLD film exhibits the optimal superconducting transition temperature Tc~31 K, much higher than those grown by other vacuum epitaxial techniques. This result indicates that PLD is an ideal approach for fabricating high-quality, high-Tc Nd1-xEuxNiO2 superconducting films. Magneto-transport measurements reveal robust field-enhanced and re-entrant superconductivity in both underdoped and overdoped regimes. At low temperatures just above the onset Tc, the Hall resistance exhibits nonlinear behavior, which may originate from magnetic impurity scattering. These results highlight the crucial role of magnetic rare-earth Eu2+ ions in producing the exotic physical properties of the infinite-layer nickelates. △ Less

Submitted 11 July, 2026; originally announced July 2026.

Comments: 10 pages, 5 figures

Electronic manipulation of polar order in electron crystal

Authors: Takashi Kikkawa, Ziyan Chen, Yuto Fujimoto, Takahiro Morimoto, Yuya Hirata, Hiroki Arisawa, Alexey A. Kaverzin, Satoshi Okamoto, Yoichi Okimoto, Naoshi Ikeda, Eiji Saitoh

Abstract: When interaction among atoms or ions is strong enough, they often arrange periodically, forming a crystal. The arrangement patterns of atoms or ions can encode information, a concept that has enabled devices such as ferroelectric memories. It has been found that not only atoms or ions but also electrons in condensed matter can crystallize when Coulomb interaction is strong enough. Typical examples… ▽ More When interaction among atoms or ions is strong enough, they often arrange periodically, forming a crystal. The arrangement patterns of atoms or ions can encode information, a concept that has enabled devices such as ferroelectric memories. It has been found that not only atoms or ions but also electrons in condensed matter can crystallize when Coulomb interaction is strong enough. Typical examples are charge-ordered states in solids, where different valences, or different electron numbers, of an ion spontaneously form a spatial pattern on the lattice. In such electron crystals, information is expected to be encoded into the electron-ordering patterns. Here, we demonstrate electronic manipulation and readout of charge-ordering directions in a paramagnetic semiconductor LuFe$_2$O$_4$. By applying current pulses at room temperature, we observed that the non-reciprocal resistivity of LuFe$_2$O$_4$ is modulated along with a sign reversal, which disappears above the charge-ordering temperature. A numerical calculation incorporating inter-band Berry curvature affected by the charge ordering is consistent with the experimental results. By applying the observed phenomenon, we also demonstrate a non-reciprocal resistance memory operation in the charge-ordered LuFe$_2$O$_4$. This result opens the door to realizing charge-ordering electronics. △ Less

Submitted 10 July, 2026; originally announced July 2026.

Comments: 39 pages, 7 figures

Interplay of Quasiperiodic Criticality and the Non-Hermitian Skin Effect

Authors: Zhangyuan Chen, Xianqi Tong, Xiaosen Yang

Abstract: Quasiperiodic lattices can host critical eigenstates, whereas nonreciprocal hopping in non-Hermitian lattices can induce non-Hermitian skin effect. In this work, we investigate localization phenomena in a Hatano--Nelson model with quasiperiodically modulated hopping amplitudes, where nonreciprocity arises from unequal modulation strengths of the right and left hoppings. Using a non-unitary gauge t… ▽ More Quasiperiodic lattices can host critical eigenstates, whereas nonreciprocal hopping in non-Hermitian lattices can induce non-Hermitian skin effect. In this work, we investigate localization phenomena in a Hatano--Nelson model with quasiperiodically modulated hopping amplitudes, where nonreciprocity arises from unequal modulation strengths of the right and left hoppings. Using a non-unitary gauge transformation, we map the non-Hermitian system into a Hermitian quasiperiodic system and obtain an exact analytical expression for the Lyapunov exponent in the thermodynamic limit. Under periodic boundary conditions, inverse participation ratios and finite-size scaling analysis are used to identify the quasiperiodic critical regimes. The comparison shows that parameter regimes hosting quasiperiodic critical states under periodic boundary conditions can exhibit the non-Hermitian skin effect under open boundary conditions. Furthermore, the non-Hermitian skin effect associated with quasiperiodic critical regimes is also observed in representative long-range hopping models and multiband extensions. Our results provide an analytically controlled perspective on how quasiperiodicity, modulated nonreciprocity, and boundary conditions jointly shape the non-Hermitian skin effect in critical regimes. △ Less

Submitted 9 July, 2026; originally announced July 2026.

Comments: 8 pages, 4 figures

Self-Driven Atomic Dispersion in Graphitic Layers

Authors: Zhaoxi Chen, Yulu He, Zhuoran Yao, Jian Liu, Jun Cai, Ziyi Fan, Wenjun Zhang, Lei Lei, Zupeng Chen, Bo Yang, Zhi Liu, Zhu-Jun Wang

Abstract: Carbon-supported single-atom catalysts maximize metal utilization, but how metal nanoparticles transform into isolated atoms within carbon remains unclear. We show that metal nanoparticles can undergo a self-driven dispersion process under hydrocarbon oxidation conditions, transforming into single atoms that are confined in carbon matrix. Using Pt-catalysed hydrocarbon oxidation as a model, we com… ▽ More Carbon-supported single-atom catalysts maximize metal utilization, but how metal nanoparticles transform into isolated atoms within carbon remains unclear. We show that metal nanoparticles can undergo a self-driven dispersion process under hydrocarbon oxidation conditions, transforming into single atoms that are confined in carbon matrix. Using Pt-catalysed hydrocarbon oxidation as a model, we combine operando electron microscopy, near-ambient-pressure X-ray photoelectron spectroscopy and mass spectrometry to track coupled structural and chemical evolution. Graphitic carbon grows at step edges of Pt nanoparticle, continuously reconstructing Pt surface and generating undercoordinated sites for atom release. In-situ generated CO accumulates at the metal-carbon interface, weakening bonding and facilitating self-amplified atom release and migration. Defective carbon overlayers then trap, stabilize and transport liberated atoms, while oxidative etching preserves interfacial access of reaction-gas. Similar behaviour across other metals suggests a general atomization pathway for single-atom catalyst synthesis, yielding products with electrocatalytic hydrogen production activity beyond standard commercial benchmarks. △ Less

Submitted 3 July, 2026; originally announced July 2026.

Comments: 30 pages, 5 figures

Structure-Dependent Chemical Order Modification in Strained Alloy Nanoparticles

Authors: Yue Wang, Zibo Chen, Evropi Toulkeridou, Joseph Kioseoglou, Panagiotis Grammatikopoulos

Abstract: Alloy nanoparticles (nanoalloys) exhibit tuneable physicochemical properties that depend sensitively on their atomic arrangement, making control over chemical ordering a central challenge in nanomaterials design. While most theoretical studies consider nanoalloys in vacuum, practical systems are typically supported, where strong cluster-substrate interactions can introduce significant lattice stra… ▽ More Alloy nanoparticles (nanoalloys) exhibit tuneable physicochemical properties that depend sensitively on their atomic arrangement, making control over chemical ordering a central challenge in nanomaterials design. While most theoretical studies consider nanoalloys in vacuum, practical systems are typically supported, where strong cluster-substrate interactions can introduce significant lattice strain. Here, we investigate strain as a control parameter for chemical ordering in bimetallic nanoalloys using atomistic molecular dynamics and Monte Carlo simulations. By imposing controlled tensile and compressive strain through an implicit anchored interface, we systematically probe the response of NiPt nanoparticles with distinct structural motifs. For truncated octahedral particles, we find that chemical ordering and segregation behaviour remain remarkably robust even under large strains, indicating that intrinsic thermodynamic preferences dominate. In contrast, icosahedral nanoparticles exhibit pronounced strain-induced chemical redistribution, with a significant increase in surface Ni concentration under tensile strain. This behaviour is attributed to the combined effects of intrinsic geometric frustration and a high fraction of undercoordinated sites in icosahedral structures. Our results demonstrate that strain can selectively modulate chemical ordering in nanoalloys in a structure-dependent manner, establishing a general framework for understanding strain-induced chemical ordering in nanoalloys. △ Less

Submitted 30 June, 2026; originally announced July 2026.

Comments: Manuscript: 17 pages, 5 figures; Supporting Information: 10 pages, 7 figures, 6 Tables

Silicon-compatible ideal antiferroelectricity with large digital electromechanical responses enabled by thermal-strain domain engineering

Authors: Hao Xiong, Huazhang Zhang, Liang Shu, Yangyang Si, Jiaqi Liu, Chao Zhou, Rui Zhang, Jingxuan Li, Jinyang Li, Chhavi Rastogi, Hao Pan, Bin Xu, Er-Jia Guo, Yunlong Tang, Sujit Das, Philippe Ghosez, Qian Li, Jing-Feng Li, Zuhuang Chen

Abstract: Antiferroelectrics exhibit reversible antipolar-polar transformations, offering a compelling platform for multiple functionalities in modern nanoelectronics, yet deterministic control of antiferroelectric domains and switching pathways remain elusive. Moreover, their integration with ubiquitous silicon-based electronic devices has been limited by the structural and chemical incompatibilities of co… ▽ More Antiferroelectrics exhibit reversible antipolar-polar transformations, offering a compelling platform for multiple functionalities in modern nanoelectronics, yet deterministic control of antiferroelectric domains and switching pathways remain elusive. Moreover, their integration with ubiquitous silicon-based electronic devices has been limited by the structural and chemical incompatibilities of conventional oxide platforms. Here, we convert the conventional drawback of thermal mismatch into a functional advantage and realize ideal antiferroelectricity in epitaxial PbZrO3 thin films on silicon through thermal tensile-strain engineering, a strain regime unattainable on conventional perovskite substrates. Combined theoretical and experimental studies show that tensile strain stabilizes the (004)o domain, enabling a direct one-step switching, whereas compressive-strain-stabilized (240)o domains switch through intermediate ferrielectric states. The resulting films exhibit near-zero remanent polarization, square double hysteresis, nanosecond switching (~75ns), large reversible electrostrain (~0.6%) and robust operation windows. These findings provide key insights into domain-engineered ideal antiferroelectricity on silicon, opening a viable route toward high-performance antiferroelectric nano-electronic devices. △ Less

Submitted 28 June, 2026; originally announced June 2026.

Comments: 23 pages, 5 figures

Optically Switched Phonon Superradiance of Surface Acoustic Wave in Diamond

Authors: Zhiwei Chen, Changyong Lei, Jie Ren

Abstract: Surface acoustic wave (SAW) phonon coupling with nitrogen-vacancy (NV) center spins in diamond offers a promising platform for on-chip quantum phononic manipulations. Although an ensemble of NV centers coupled to a common SAW phonon mode enables superradiance and collective quantum control, achieving a tunable superradiant phase transition remains challenging. Here, we show that optically driving… ▽ More Surface acoustic wave (SAW) phonon coupling with nitrogen-vacancy (NV) center spins in diamond offers a promising platform for on-chip quantum phononic manipulations. Although an ensemble of NV centers coupled to a common SAW phonon mode enables superradiance and collective quantum control, achieving a tunable superradiant phase transition remains challenging. Here, we show that optically driving NV centers level transitions enhances the effective spin-phonon coupling, triggering a SAW phonon superradiant phase transition in the weak-coupling regime. We also demonstrate that above a critical threshold, the driving light rapidly switches on the phonon superradiance--a dynamic effect that persists in finite-number NV ensembles. Our results provide a controllable route to coherent phonon-NV spin manipulation in solid state quantum devices. △ Less

Submitted 27 June, 2026; originally announced June 2026.

Comments: 11 pages, 7 figures

Unlocking Cryogenic Energy Storage by Constructing Dipole Glass with Unit-cell-level Polar Disorder

Authors: Yangyang Si, Denan Li, Yijie Li, Changsheng Chen, Jingxuan Li, Chao Zhou, Hao Xiong, Tianfu Zhang, Wenjin Liao, Zhongqi Ren, Huaicheng Yuan, Dong Li, Jing-Kai Qin, Cheng-Yan Xu, Ye Zhu, Yunlong Tang, Sujit Das, Jieun Kim, Junling Wang, Hao Pan, Fei Li, Zhen Chen, Shi Liu, Zuhuang Chen

Abstract: Cryogenic energy storage is vital for frontier technologies including deep-space exploration and quantum computing, yet conventional electrochemical energy systems fail below ~230 K due to frozen ion migration. While relaxor-based dielectric capacitors provide high efficiency at room temperature, the intrinsic freezing/growth of polar nanodomains at extended cryogenic regime limits their applicati… ▽ More Cryogenic energy storage is vital for frontier technologies including deep-space exploration and quantum computing, yet conventional electrochemical energy systems fail below ~230 K due to frozen ion migration. While relaxor-based dielectric capacitors provide high efficiency at room temperature, the intrinsic freezing/growth of polar nanodomains at extended cryogenic regime limits their applications with deteriorated hysteresis losses. Here, we realize superior cryogenic energy-storage performance by designing unit-cell-level disordered dipole-glass state in Pb0.6Sr0.4ZrO3 thin films with composition near antiferroelectric-paraelectric phase boundary. The antiferroelectric-derived dipole-glass introduces enhanced unit-cell-level complexity of dipole interaction that suppresses long-range ferroelectric order. This enables ultralow-hysteresis operation (efficiency > 88%) down to 4 K, delivering record-high energy density (211 J/cm^3) at 9 MV/cm, stability over 10^8 charge/discharge cycles and microsecond-scale charge/discharge capability. This work establishes a dipole-glass paradigm for cryogenic dielectric capacitors, opening a new avenue to highly-efficient energy-storage systems with broad applications in frontier nanoelectronics. △ Less

Submitted 26 June, 2026; originally announced June 2026.

Comments: 23 pages, 4 figures

Formation and dynamics of self-bound droplets in dipolar molecular condensate

Authors: Xinyi Tang, Tianmiao Zhang, Zibin Zhao, Guilong Li, Zhaopin Chen, Bin Liu, Boris A. Malomed, Yongyao Li

Abstract: Recent advances in the work with ultracold condensates of polar molecules have enabled the realization of highly tunable self-bound quantum droplets (QDs), with the help of dual microwave fields dressig the dipole-dipole interactions (DDIs) It has been reported that symmetry properties and the equilibrium phase diagram of such QDs can be controlled by parameters of the two microwave fields. Howeve… ▽ More Recent advances in the work with ultracold condensates of polar molecules have enabled the realization of highly tunable self-bound quantum droplets (QDs), with the help of dual microwave fields dressig the dipole-dipole interactions (DDIs) It has been reported that symmetry properties and the equilibrium phase diagram of such QDs can be controlled by parameters of the two microwave fields. However, the effect of these fields on the formation and dynamics of the QD has not yet been systematically explored. Here we address self-bound QDs in a regime dominated by non-axisymmetric DDIs and governed by the extended Gross-Pitaevskii equation with the Lee-Huang-Yang corrections. Within this framework, we identify the existence region of the self-bound QDs and characterize their chemical potential, total energy, effective volume, peak density, and geometric anisotropy. The results reveal a pronounced nonmonotonous dependence on the non-axisymmetric DDI strength, whereas the increase of the number of particles in the condensate leads to tighter bound and more anisotropic QDs. Furthermore, reducing the s-wave scattering length drives a transition from stable self-bound states to the collapse. Collisions between QDs moving along different directions reveal a strong directional dependence, with outcomes ranging from quasi-elastic rebound and merger to fragmentation. △ Less

Submitted 21 June, 2026; originally announced June 2026.

Comments: 9 pages, 8 figures, and 66 References

Berry-phase-based Topological Charge in Quasicrystals and their Observable Features in Photonic System

Authors: Ziyi Chen, Jinyu Zou, Jinhua Gao, Gang xu

Abstract: Topological charges based on Berry phase play the fundamental role in the topological physics. However, such topological charges remain unexplored in quasicrystals, impeding the systematic understanding of topological states in such quasiperiodic systems. In this work, by deriving all the allowed topological charges according to group representation theory and the corresponding low-energy effectiv… ▽ More Topological charges based on Berry phase play the fundamental role in the topological physics. However, such topological charges remain unexplored in quasicrystals, impeding the systematic understanding of topological states in such quasiperiodic systems. In this work, by deriving all the allowed topological charges according to group representation theory and the corresponding low-energy effective Hamiltonians, we establish a universal framework for Berry-phase-based topological charges in two-dimensional quasicrystals. Taking the $C_{8v}$ quasicrystal as an example, we demonstrate and characterize a higher topological charge of $C=4$, which is inaccessible in conventional periodic systems. Applying our framework to photonic quasicrystals, we uncover that the circling of photon momentum around the charge gives a $C$ times winding of the electromagnetic field distribution pattern. Such observable feature provides a direct experimental method to probe the topological charges. Our work paves the way for exploring topological charges in quasiperiodic matter, and fundamentally bridges periodic and quasiperiodic topological band theories. △ Less

Submitted 10 June, 2026; originally announced June 2026.

Comments: 8 pages, 3 figures

Layer-parity-defined surface polarization in Nb$_3$Cl$_8$ for excitonic modulation at van der Waals interfaces

Authors: Xinyue Huang, Hansheng Xu, Yuchen Gao, Yushen Zhou, Zhijie Ma, Kenji Watanabe, Takashi Taniguchi, Zuxin Chen, Jianqi Huang, Jianpeng Liu, Teng Yang, Youguo Shi, Yu Ye

Abstract: The intrinsic symmetry breaking in the breathing kagome lattice of layered Nb$_3$Cl$_8$ provides a unique mechanism for realizing electrically polar surfaces. In each monolayer, the trimerization of Nb atoms breaks inversion and mirror symmetries, generating an out-of-plane electric dipole. The AB-stacked $α$ phase arranges adjacent layer dipoles antiferroelectrically, leaving the uncompensated su… ▽ More The intrinsic symmetry breaking in the breathing kagome lattice of layered Nb$_3$Cl$_8$ provides a unique mechanism for realizing electrically polar surfaces. In each monolayer, the trimerization of Nb atoms breaks inversion and mirror symmetries, generating an out-of-plane electric dipole. The AB-stacked $α$ phase arranges adjacent layer dipoles antiferroelectrically, leaving the uncompensated surface polarization strictly governed by layer parity. Here, using atomic force microscopy operated in Kelvin probe force microscopy mode, we directly visualize layer-dependent polarization states in exfoliated Nb$_3$Cl$_8$ flakes and resolve a pronounced odd-even oscillation of the surface electrostatic potential. Beyond this parity-locked antiferroelectric order, we further identify intralayer polar domains in which local atomic reconstructions of the breathing kagome network reverse the out-of-plane dipole of the surface layer, producing ferroelectric-like stacking configurations. By interfacing monolayer MoSe$_2$ with Nb$_3$Cl$_8$, we demonstrate that these surface-polarization textures effectively modulate adjacent excitonic emission through domain-dependent interfacial band alignment and charge transfer. Our findings establish Nb$_3$Cl$_8$ as an intrinsic layer-polarized van der Waals platform and show that layer parity provides powerful structural degree of freedom for programming excitonic and optoelectronic responses at van der Waals interfaces. △ Less

Submitted 8 June, 2026; originally announced June 2026.

Comments: 9 pages, 4 figures

Bipolar-doped superconducting infinite-layer cuprates

Authors: Fengzhe Wang, Yueying Li, Heng Wang, Lizhi Xu, Xianfeng Wu, Lixiang Xu, Guangdi Zhou, Jin-Feng Jia, Peng Li, Haoliang Huang, Qi-Kun Xue, Zhuoyu Chen

Abstract: Distilling the intrinsic physics of the superconducting CuO2 plane from the complexities of charge-reservoir layers is a defining challenge in high-temperature superconductivity. While superconducting electron-doped infinite-layer cuprates have been synthesized, controllable and uniform hole doping has long remained elusive despite exploratory attempts, limiting spectroscopic insights. Here, we re… ▽ More Distilling the intrinsic physics of the superconducting CuO2 plane from the complexities of charge-reservoir layers is a defining challenge in high-temperature superconductivity. While superconducting electron-doped infinite-layer cuprates have been synthesized, controllable and uniform hole doping has long remained elusive despite exploratory attempts, limiting spectroscopic insights. Here, we realize bipolar doping across infinite-layer (Sr,Eu)CuO2 and (Ca,Li)CuO2+δ single-crystalline thin films, mapping the electronic phase diagram. Both electron- and hole-doped films show pronounced electrical resistance anisotropy, indicating the quasi-two-dimensional nature of the CuO2 planes. Angle-resolved photoemission spectroscopy across electron- and hole-doped regimes reveals persistent antiferromagnetic band folding coexisting with superconductivity. Remarkably, at a hole doping ~0.07 determined by Luttinger volume, the antiferromagnetic folding emerges from Fermi arcs within the film's single Fermi surface, with the onset superconducting transition temperature exceeding 60 K. These findings redefine the interplay between magnetic order and superconductivity and establish a definitive platform to investigate the intrinsic mechanism of high-temperature superconducting cuprates. △ Less

Submitted 2 June, 2026; originally announced June 2026.

Resonant Raman scattering in bilayer 3R-MoS$_{2}$

Authors: Chinmay K. Mohanty, Kacper Walczyk, Tomasz Woźniak, Chengcheng Jiang, Adam Babiński, Clement Faugeras, Zhaolong Chen, Maciej R. Molas

Abstract: Raman scattering is a powerful spectroscopic technique widely employed to investigate light-matter interactions and lattice dynamics in two-dimensional materials. Here, we investigate the temperature-dependent resonant Raman response of bilayer 3R-MoS$_2$. The study combines multi-wavelength Raman spectroscopy, photoluminescence measurements, and density functional theory calculations to track the… ▽ More Raman scattering is a powerful spectroscopic technique widely employed to investigate light-matter interactions and lattice dynamics in two-dimensional materials. Here, we investigate the temperature-dependent resonant Raman response of bilayer 3R-MoS$_2$. The study combines multi-wavelength Raman spectroscopy, photoluminescence measurements, and density functional theory calculations to track the evolution of excitonic transitions and resonance conditions. We observe contributions from both zone-centre and finite-momentum phonons, a pronounced quenching of the Stokes intensity at low temperatures followed by saturation, the emergence of anti-Stokes scattering above 130~K, and a strong deviation of the effective phonon temperature from the lattice temperature induced by resonance effects. These results demonstrate that the Raman response is governed by the interplay between incoming and outgoing resonance processes, providing deeper insight into exciton-phonon coupling in van der Waals materials. △ Less

Submitted 31 May, 2026; originally announced June 2026.

Comments: 9 pages, 4 figures + SI

Everything at Every Scale: Scale-Invariant Diffusion with Continuous Super-Resolution

Authors: Zixin Jessie Chen, Zhuo Chen, Archer Wang, Jeff Gore, William T. Freeman, Congyue Deng, Marin Soljačić

Abstract: Creating images from noise is image generation; reconstructing fine details from coarse inputs is super-resolution. Despite their practical differences, both can be understood as reversing information loss across scales. We introduce $\textbf{SKILD}$, a $\textbf{S}$cale-invariant $\textbf{K}$-Space $\textbf{I}$mage $\textbf{L}$earning $\textbf{D}$iffusion model that unifies generation and continuo… ▽ More Creating images from noise is image generation; reconstructing fine details from coarse inputs is super-resolution. Despite their practical differences, both can be understood as reversing information loss across scales. We introduce $\textbf{SKILD}$, a $\textbf{S}$cale-invariant $\textbf{K}$-Space $\textbf{I}$mage $\textbf{L}$earning $\textbf{D}$iffusion model that unifies generation and continuous super-resolution within a single unconditional framework. Both natural images and critical physical systems exhibit scale invariance, and we leverage it to design a forward process that attenuates image content from fine to coarse scales while injecting spectrum-matched Gaussian noise, making scale an explicit coordinate of the diffusion dynamics. The same trained reverse process performs generation and continuous super-resolution by varying only the starting timestep: $\textit{no task-specific architecture, no conditioning branch, no classifier-free guidance, no retraining per scale factor}$. Empirically, SKILD reaches FID $2.65$ and Inception Score $9.63$ on unconditional CIFAR-10, performs $2\times$--$8\times$ super-resolution on ImageNet from a single unconditional checkpoint while outperforming conditional models across perceptual metrics, and reconstructs critical Ising models whose connected four-point correlations closely track the ground truth. △ Less

Submitted 25 May, 2026; originally announced May 2026.

Comments: 29 pages, 17 figures

Termination-Dependent Surface States and Magnetic Fingerprints of Chiral Helimagnet Cr1/3TaS2

Authors: Bo Liang, Xue Li, Congcong Le, Zirui Wu, Wenpei Zhu, Neng Cai, Yong-Chang Lau, Xianxin Wu, Jiayu Liu, Zhanfeng Liu, Hongen Zhu, Tongrui Li, Zhicheng Jiang, Yu Huang, Wenchuan Jing, Xun Ma, Qi Jiang, Hang Li, Zhihao Cai, Xuezhi Chen, Gexing Qu, Yiwei Cheng, Bing-Jie Chen, Zhengtai Liu, Dawei Shen , et al. (14 additional authors not shown)

Abstract: Chiral helimagnets based on intercalated transition-metal dichalcogenides, characterized by nano-scale spin ordering, provide a powerful route to engineer chiral spin textures (e.g. the topologically protected magnetic solitons) and emergent electronic functionality at reduced dimensions, where surface and interface states often dominate device operation. However, despite growing interest, direct… ▽ More Chiral helimagnets based on intercalated transition-metal dichalcogenides, characterized by nano-scale spin ordering, provide a powerful route to engineer chiral spin textures (e.g. the topologically protected magnetic solitons) and emergent electronic functionality at reduced dimensions, where surface and interface states often dominate device operation. However, despite growing interest, direct experimental studies of termination-dependent surface electronic structures and their temperature-driven magnetic evolution remain largely unexplored, hindering a microscopic understanding of the electronic states that is crucial for the development of low-dimensional spintronic devices. Here, for the first time, taking Cr1/3TaS2 as a representative example, we systematically investigate the termination-dependent surface electronic states of the chiral helimagnets and uncover their distinct temperature evolution across the magnetic transition (TC~142K) by combining high-resolution ARPES with a micro-focused beam and surface-state-resolved first-principles calculations. The TaS2-terminated surface hosts folded monolayer-like TaS2 bands under the $\sqrt3\times\sqrt3$ superlattice potential and a shallow triangular electron pocket at the superlattice $\bar K$ point arising from Cr-Ta orbital hybridization. In contrast, the Cr-terminated surface exhibits reconstructed hole pockets with pronounced magnetic band splitting. This splitting disappears above TC and closely follows the chiral helimagnetic order parameter, providing a direct spectroscopic fingerprint of chiral helimagnetic order. In addition, multiple ultranarrow Cr-d-derived surface flat bands are resolved. These findings establish Cr1/3TaS2 as a model system in which surface electronic states are strongly coupled to chiral magnetism, opening new opportunities for chiral spintronic and valleytronic micro/nanodevices. △ Less

Submitted 23 May, 2026; originally announced May 2026.

Interaction-enabled metal-insulator phase transition in a driven quantum gas

Authors: Camilo Cantillano, Karthick Ramanathan, Zekai Chen, Ang Yang, Emilio Aguilera-Valdes, Lei Ying, Manuele Landini, Hanns-Christoph Nägerl, Yanliang Guo

Abstract: Particle transport and energy flow are central to a wide range of phenomena in the natural sciences. While interactions generically promote ergodicity and diffusion, quantum interference can arrest transport, defying classical expectations. Here, we experimentally investigate their interplay in a periodically driven 3D quantum gas with tunable interactions. Strikingly, we find a sharp dynamical bo… ▽ More Particle transport and energy flow are central to a wide range of phenomena in the natural sciences. While interactions generically promote ergodicity and diffusion, quantum interference can arrest transport, defying classical expectations. Here, we experimentally investigate their interplay in a periodically driven 3D quantum gas with tunable interactions. Strikingly, we find a sharp dynamical boundary separating localization from diffusive energy absorption. By tuning the driving amplitude and interaction strength, we map the localization-delocalization phase diagram and characterize this boundary via finite-time scaling. On the insulating side, we observe many-body dynamical localization (MBDL) featuring arrested momentum-space transport. Transport becomes subdiffusive near the boundary and diffusive in the delocalized regime, yielding a metal-insulator transition that we interpret as localization in many-body Hilbert space. Our results exemplify an interaction-enabled dynamical phase transition in a closed Floquet many-body system, and clarify how coherence and interactions jointly govern the quantum-to-classical transition. △ Less

Submitted 7 June, 2026; v1 submitted 21 May, 2026; originally announced May 2026.

Destructive interference of second harmonic generation in AA stacked MoTe$_2$/WSe$_2$

Authors: Yiduo Wang, Yao Lu, Changshen Chen, Xiaotong Liao, Siyu Fan, Zhenyu Wang, Yaotian Liu, Subi Du, Yingze Jia, Ye Zhu, Yingwei Wang, Jun He, Song Liu, Jiawei Ruan, Zhen Chen, Kai-Qiang Lin, Yang Xu

Abstract: The stacking configuration of two-dimensional materials critically governs their optical and electronic responses. Monolayer transition-metal dichalcogenides (TMDC) lack inversion symmetry and exhibit exciton-enhanced second-harmonic generation (SHG). In TMDC bilayers, 60° (0°) stacking is conventionally expected to suppress (enhance) SHG owing to destructive (constructive) interference of the lay… ▽ More The stacking configuration of two-dimensional materials critically governs their optical and electronic responses. Monolayer transition-metal dichalcogenides (TMDC) lack inversion symmetry and exhibit exciton-enhanced second-harmonic generation (SHG). In TMDC bilayers, 60° (0°) stacking is conventionally expected to suppress (enhance) SHG owing to destructive (constructive) interference of the layer-resolved nonlinear polarizations. Here, we report an unconventional destructive SHG interference in nearly 0°-stacked (AA-stacked) MoTe2/WSe2 heterobilayers using two independent probes: atomic-resolution imaging and stacking-sensitive exciton hybridization measurements. Supported by ab initio GW and Bethe-Salpeter equation calculations, we show that distinct two-photon resonances associated with the WSe2 C exciton and the MoTe2 D exciton generate a nearly $π$ phase difference ($Δφ$) in their second-order nonlinear susceptibilities $χ^{(2)}$, leading to the anomalous destructive interference. We further demonstrate that in small-angle twisted MoTe2/WSe2, the SHG polarization state is governed by the interplay between twist angle $α$ and phase difference $Δφ$, and can be mapped onto trajectories on the Poincaré sphere. At excitation energies satisfying $Δφ$ + 3$α$ = 180°, the SHG output becomes nearly circularly polarized (ellipticity ~ 0.91) and undergoes an abrupt 90° azimuthal rotation, corresponding to a geometric polarization singularity in the parameter space. Our findings open new routes for exciton-resonance engineered nonlinear photonics and stacking-resolved optical functionality in moiré materials. △ Less

Submitted 20 May, 2026; originally announced May 2026.

Comments: 35 pages, 4 main figures and 10 supplemental figures

Topological phononics

Authors: Zeguo Chen, Tiantian Zhang, Xulong Wang, Jiangxu Li, Zhi-Kang Lin, Feng Gao, Li-Wei Wang, Yizhou Liu, Qi Wang, Xiujuan Zhang, Guancong Ma, Xingqiu Chen, Minghui Lu, Yanfeng Chen, Jian-Hua Jiang

Abstract: Topological phononics extends the foundational concepts of topological condensed matter physics to the realm of lattice vibrations and classical mechanical waves, unlocking robust, defect-immune states and phenomena beyond the reach of conventional phononic engineering. This review provides a unified, systematic framework for understanding topological phonons across natural and artificial systems,… ▽ More Topological phononics extends the foundational concepts of topological condensed matter physics to the realm of lattice vibrations and classical mechanical waves, unlocking robust, defect-immune states and phenomena beyond the reach of conventional phononic engineering. This review provides a unified, systematic framework for understanding topological phonons across natural and artificial systems, spanning solid-state materials, acoustic/mechanical metamaterials, and non-Hermitian platforms. We cover the core theoretical principles -- from Berry curvature and symmetry-protected topological invariants to bulk-boundary correspondence -- alongside experimental advances in probing topological phonon states via inelastic scattering and momentum-resolved techniques for solid-state phonons as well as pump-probe measurements in acoustic/mechanical metamaterials. Key topics include Weyl/Dirac/nodal-line phonons in crystalline solids, symmetry-engineered topological phases in metamaterials, non-Hermitian effects (exceptional points, skin effect), and emergent directions such as Floquet engineering, synthetic dimensions, and real-space topological textures (skyrmions, merons). We also highlight technological applications in robust waveguides, on-chip surface-acoustic-wave devices, and acoustofluidics, while outlining future challenges and opportunities in quantum phononics, nonlinear topological phenomena, and interdisciplinary integration with photonics and electronics. This review serves as a comprehensive guide across physics, materials science, and engineering, bridging fundamental theory with cutting-edge experiments and innovations in topological phononics. △ Less

Submitted 20 May, 2026; originally announced May 2026.

Comments: All comments are welcome

LEAP: A closed-loop framework for perovskite precursor additive discovery

Authors: Xin-De Wang, Zhi-Rui Chen, Ze-Feng Gao, Peng-Jie Guo, Cheng Mu, Zhong-Yi Lu

Abstract: Efficient discovery of precursor additives is essential for improving the performance of perovskite solar cells, yet the large chemical space makes conventional trial-and-error screening inefficient. We develop LEAP(LLM-driven Exploration via Active Learning for Perovskites), an expert-in-the-loop closed framework that couples a domain-specialized large language model(LLM) with active learning for… ▽ More Efficient discovery of precursor additives is essential for improving the performance of perovskite solar cells, yet the large chemical space makes conventional trial-and-error screening inefficient. We develop LEAP(LLM-driven Exploration via Active Learning for Perovskites), an expert-in-the-loop closed framework that couples a domain-specialized large language model(LLM) with active learning for iterative additive prioritization. The LLM is trained to extract mechanism-relevant knowledge from the perovskite additive literature and to represent candidate molecules through interpretable descriptors, which are further integrated into a Bayesian optimization workflow for uncertainty-aware prioritization under low-data conditions. Benchmark results on unseen literature show that the domain-specialized model outperforms general-purpose models in mechanism-consistent reasoning. Experimental validation in an expert-in-the-loop proof-of-concept study suggests improved additive prioritization across three screening rounds, leading to average device PCEs of 20.13% and 20.87% for the later-round 6-CDQ- and 2-CNA-treated devices, respectively, compared with 19.25% for the control, with a champion PCE of 21.32%. These results provide preliminary evidence that literature-grounded mechanistic descriptors, when coupled with Bayesian optimization and expert feasibility review, can support mechanism-aware additive prioritization in perovskite photovoltaics. △ Less

Submitted 17 May, 2026; originally announced May 2026.

Comments: 30 pages; 11 figures

Atomically resolved intrinsic superconducting gap in (La,Pr)3Ni2O7 films

Authors: Xinxin Wang, Yaqi Chen, Cui Ding, Lizhi Xu, Jian-Jian Miao, Guangdi Zhou, Zhuoyu Chen, Yu-Jie Sun, Jin-Feng Jia, Qi-Kun Xue

Abstract: Ruddlesden-Popper bilayer nickelates provide an emerging platform for studying high-temperature superconductivity, yet the superconducting pairing symmetry remains under debate. Here, we use atomic-resolution scanning tunnelling microscopy and spectroscopy to investigate superconducting 1.5-unit-cell (La,Pr)3Ni2O7 films grown on SrLaAlO4. A cryogenic ultrahigh-vacuum (UHV) sample transfer preserve… ▽ More Ruddlesden-Popper bilayer nickelates provide an emerging platform for studying high-temperature superconductivity, yet the superconducting pairing symmetry remains under debate. Here, we use atomic-resolution scanning tunnelling microscopy and spectroscopy to investigate superconducting 1.5-unit-cell (La,Pr)3Ni2O7 films grown on SrLaAlO4. A cryogenic ultrahigh-vacuum (UHV) sample transfer preserves an ordered sqrt(2) * sqrt(2) surface and yields reproducible U-shaped spectra with two gap scales of ~14 and ~20 meV and extended flat zero-conductance bottoms. By contrast, samples exposed for a longer time in UHV without cooling during transfer show V-shaped spectra despite retaining the surface reconstruction and a transport superconducting transition onset above 40 K. Wide-energy-range spectra indicate that oxygen loss can mix density-wave-related spectral weight. Our measurements provide an atomic-scale observation of the intrinsic nodeless superconducting gap in bilayer nickelate ultrathin films. △ Less

Submitted 14 May, 2026; originally announced May 2026.

Cascade of fractional quantum Hall states in 2D system

Authors: Zhimou Chen, Jiaojie Yan, Yuxuan Zhu, Zhe Cui, Loren N. Pfeiffer, Kenneth W. West, Kirk W. Baldwin, Adbhut Gupta, Yang Liu, Wei Zhu, Wenchen Luo, Ying-Hai Wu, Shuai Yuan, Xi Lin

Abstract: The observation of the fractional quantum Hall (FQH) effect in 2D electron gases ushered in investigations of topological phases driven by strong electron correlations. Their remarkable features include fractionalized elementary excitations, gapless boundary states, and non-trivial quantum entanglement patterns. Thanks to persistent efforts in the building of new platforms and making higher-qualit… ▽ More The observation of the fractional quantum Hall (FQH) effect in 2D electron gases ushered in investigations of topological phases driven by strong electron correlations. Their remarkable features include fractionalized elementary excitations, gapless boundary states, and non-trivial quantum entanglement patterns. Thanks to persistent efforts in the building of new platforms and making higher-quality samples, a diverse plethora of FQH states have been unveiled in experiments. We report a systematic study of ultrahigh-quality GaAs/AlGaAs quantum wells with mobility up to 3.7*10^7 cm^2/V/s using quantum transport measurements in nuclear adiabatic demagnetization and dilution refrigerators down to 1 mK. In addition to many FQH states that have already been identified in previous work, new longitudinal resistance dips are observed at filling factors 17/33 and 15/31. The application of an in-plane magnetic field causes disparate variations of the FQH states. The theoretical foundation of these states is discussed in the framework of composite fermion theory. While most fractions can be explained as non-interacting composite fermions forming integer quantum Hall states, a few states correspond to FQH states of composite fermions that arise from residual interaction between them. We summarize the observed fractions in the range of 0 < ν < 2 and propose a pattern to account for their experimental appearance that provides an intuitive picture about the relative strengths of different FQH states. △ Less

Submitted 11 May, 2026; originally announced May 2026.

Comments: 15 pages, 4 figures and 1 table in manuscript; 5 pages and 4 figures in supplemental material

Journal ref: National Science Review 13(8): nwag079, 2026

MatterSim-MT: A multi-task foundation model for in silico materials characterization

Authors: Han Yang, Xixian Liu, Chenxi Hu, Yichi Zhou, Yu Shi, Chang Liu, Junfu Tan, Jielan Li, Guanzhi Li, Qian Wang, Yu Zhu, Zekun Chen, Shuizhou Chen, Fabian Thiemann, Claudio Zeni, Matthew Horton, Robert Pinsler, Andrew Fowler, Daniel Zügner, Tian Xie, Lixin Sun, Yicheng Chen, Lingyu Kong, Yeqi Bai, Deniz Gunceler , et al. (3 additional authors not shown)

Abstract: Accurate property characterization is a major bottleneck in materials design. While first-principles methods and task-specific machine-learning models have driven important progress, they remain fundamentally limited in scalability and generalizability across the vast space of structures and properties relevant to real-world materials design. We present MatterSim-MT, a multi-task foundation model… ▽ More Accurate property characterization is a major bottleneck in materials design. While first-principles methods and task-specific machine-learning models have driven important progress, they remain fundamentally limited in scalability and generalizability across the vast space of structures and properties relevant to real-world materials design. We present MatterSim-MT, a multi-task foundation model for in silico materials simulation and property characterization. The model is pretrained on over 35 million first-principles-labeled structures covering 89 elements, temperatures up to 5000 K and pressures up to 1000 GPa, and is fine-tuned on various properties including Bader charges, magnetic moments, Born effective charges, and dielectric matrices. Out of the box, MatterSim-MT not only serves as a foundation model for predicting material structure, dynamics and thermodynamics, its multi-task architecture also enables a wide range of complex simulations that cannot be captured by potential energy surfaces alone. For example, we demonstrate pressure-dependent LO-TO phonon splitting in SiC with close agreement with experiment, electric hysteresis in ferroelectric BaTiO3, and the cationic-to-anionic redox transition during delithiation of a Li-rich cathode material. Finally, we show that MatterSim-MT scales well with more data and parameters, can be efficiently fine-tuned to higher levels of theory, and can be efficiently extended to new systems via active learning. Overall, we believe this approach provides a scalable route to accurate in silico materials characterization. △ Less

Submitted 28 May, 2026; v1 submitted 8 May, 2026; originally announced May 2026.

Regulating oxygen content and superconductivity in La$_3$Ni$_2$O$_{7+δ}$

Authors: Peiyue Ma, Jingyuan Li, Xing Huang, Yixing Zhao, Yifeng Han, Mengwu Huo, Deyuan Hu, Chaoxin Huang, Hengyuan Zhang, Sihao Deng, Lunhua He, Juan Rodriguez-Carvajal, Abhisek Bandyopadhyay, Alessandro Puri, Devashibhai Adroja, Xiang Chen, Tao Xie, Zhen Chen, Hualei Sun, Meng Wang

Abstract: The synthesis of high-quality Ruddlesden-Popper (RP) nickelates remains challenging due to variations in oxygen content and the prevalence of intergrown RP phases. Precisely controlling the stoichiometry and characterizing the resulting physical properties are essential for understanding the mechanism of high-$T_c$ superconductivity in these materials. In this work, we synthesize a series of La… ▽ More The synthesis of high-quality Ruddlesden-Popper (RP) nickelates remains challenging due to variations in oxygen content and the prevalence of intergrown RP phases. Precisely controlling the stoichiometry and characterizing the resulting physical properties are essential for understanding the mechanism of high-$T_c$ superconductivity in these materials. In this work, we synthesize a series of La$_3$Ni$_2$O$_{7+δ}$ samples with systematically controlled oxygen content and perform comprehensive structural and compositional analyses. Precise oxygen tuning enables us to tailor the microstructure, yielding a pure bilayer phase, a mixture of bilayer and hybrid single-layer-bilayer phases, and a predominantly bilayer phase containing trilayer intergrowths. High-pressure transport measurements reveal distinct superconducting transitions with contrasting $T_c$ values, corresponding to the bilayer phase, the hybrid phase, and trilayer inclusions. Notably, we find that oxygen content not only governs the phase purity$-$i.e., the presence of intergrowth phases$-$but also directly modulates the upper critical field ($H_{c2}$) of the bilayer superconductivity. By establishing a phase diagram of $T_c$ and $H_{c2}$ as functions of oxygen content in La$_3$Ni$_2$O$_{7+δ}$, this work advances synthetic control and provides new insights into the superconducting mechanism of RP nickelates. △ Less

Submitted 6 May, 2026; originally announced May 2026.

Flux-Mediated Correspondence Between Real- and Momentum-Space Nonsymmorphicity

Authors: Z. Y. Chen, Y. X. Zhao

Abstract: Momentum-space nonsymmorphic symmetries have recently attracted significant interest in both artificial and condensed-matter crystals, whereas real-space nonsymmorphic symmetries have long played an important role in the study of crystalline topological phases. Here, we establish a general theory of momentum-space crystallographic groups that emerge from projective representations of real-space cr… ▽ More Momentum-space nonsymmorphic symmetries have recently attracted significant interest in both artificial and condensed-matter crystals, whereas real-space nonsymmorphic symmetries have long played an important role in the study of crystalline topological phases. Here, we establish a general theory of momentum-space crystallographic groups that emerge from projective representations of real-space crystallographic groups in the presence of gauge flux, applicable in particular to real-space nonsymmorphic groups. A central result is a flux-mediated ``bi-nonsymmorphicity'' relation that reveals a structural correspondence between real-space and momentum-space nonsymmorphicity mediated by gauge flux. This relation implies that, under a symmetric gauge flux, real-space nonsymmorphicity can enforce momentum-space nonsymmorphicity, and that in some cases a symmetric gauge flux requires nonsymmorphicity in both real and momentum space. Our work not only identifies a fundamental structure in projective crystal symmetries, but also provides guiding principles for designing artificial crystals and condensed-matter platforms that exhibit both real-space and momentum-space nonsymmorphic symmetries. △ Less

Submitted 29 April, 2026; originally announced April 2026.

Comments: 42 pages, 6 pages for main text + 36 pages for supplementary materials

Nitrogen doping induced metal-insulator transition with iso-symmetric character in rutile VO2

Authors: Baichen Lin, Shanquan Chen, Yubo Zhang, Yangyang Si, Haoliang Huang, Chuanrui Huo, Frans Munnik, Yongqi Dong, Lu You, Jian Shao, Yu-Chieh Ku, Nguyen Nhat Quyen, Aryan Keshri, Zhenlin Luo, Weiwei Zhao, Chun-Fu Chang, Chih-Wei Luo, Sujit Das, Shiqing Deng, Chang-Yang Kuo, Zuhuang Chen

Abstract: Metal-insulator transitions (MITs) in correlated oxides offer immense potential for next-generation Mottronic devices. However, their integration into practical applications is often hindered by the coupling of MITs with symmetry-lowering structural phase transitions, which limits switching speed and endurance. In this study, we engineered an iso-symmetric MIT on average in epitaxial rutile VO2 th… ▽ More Metal-insulator transitions (MITs) in correlated oxides offer immense potential for next-generation Mottronic devices. However, their integration into practical applications is often hindered by the coupling of MITs with symmetry-lowering structural phase transitions, which limits switching speed and endurance. In this study, we engineered an iso-symmetric MIT on average in epitaxial rutile VO2 thin films via an in-situ nitrogen doping strategy. Nitrogen incorporation effectively suppresses V-V dimerization, enabling an iso-symmetric MIT, while preserving the original crystal symmetry. Furthermore, in-operando time-resolved optical reflectivity measurements revealed a shortened switching time in nitrogen-doped films, highlighting their enhanced performance. Our findings provide critical insights into the underlying mechanisms of MITs and introduce anion doping as a powerful tool for tailoring phase transitions in strongly correlated electron systems. This approach opens new avenues for the development of high-performance electronic and photonic devices. △ Less

Submitted 27 April, 2026; originally announced April 2026.

Comments: 17 pages, 4 figures, accpeted by Newton

Cryogenic shock exfoliation for ultrahigh mobility rhombohedral graphite nanoelectronics

Authors: Ludwig Holleis, Youngjoon Choi, Canxun Zhang, Jack H. Farrell, Gabriel Bargas, Audrey Hsu, Zexing Chen, Ian Sackin, Wenjie Zhou, Yi Guo, Thibault Charpentier, Yifan Jiang, Benjamin A. Foutty, Aidan Keough, Martin E. Huber, Takashi Taniguchi, Kenji Watanabe, Andrew Lucas, Andrea F. Young

Abstract: Rhombohedral multilayer graphene (RMG) offers a highly tunable platform for correlated electron physics, featuring field-effect control of magnetic, superconducting, and topological phases[1-24]. The promise of these materials has been held back by the limited abundance of rhombohedral stacking in natural graphite, which constrains both sample yield and useful area. Here we introduce 'cryogenic sh… ▽ More Rhombohedral multilayer graphene (RMG) offers a highly tunable platform for correlated electron physics, featuring field-effect control of magnetic, superconducting, and topological phases[1-24]. The promise of these materials has been held back by the limited abundance of rhombohedral stacking in natural graphite, which constrains both sample yield and useful area. Here we introduce 'cryogenic shock exfoliation' to produce large area rhombohedral graphene flakes which, combined with a low-pressure van der Waals assembly technique that preserves stacking order, enable highly uniform devices exceeding 1300 $μm^2$ with fabrication yields of 90%. Using scanning nanoSQUID-on-tip imaging, we demonstrate uniform spin magnetism over the full central 10 times 10 $μm^2$ area of our devices. Transverse magnetic focusing reveals a disorder mean free path exceeding 200 $μm$ at low temperatures. Within the flat surface bands of RMG[20], we observe a size-driven crossover from Poiseuille to porous electron flow in the intermediate-temperature regime of strong electron-electron hydrodynamics[16, 25], providing a further signature of ultrahigh device quality. Our approach overcomes a key materials bottleneck in the fabrication of mesoscopic rhombohedral graphene devices, paving the way for incorporating strongly correlated phases into two-dimensional nanoelectronics. △ Less

Submitted 6 July, 2026; v1 submitted 23 April, 2026; originally announced April 2026.

$3d_{z^2}$ orbital delocalization and magnetic collapse in superconducting (La,Pr)$_3$Ni$_2$O$_{7-δ}$ films

Authors: Xiaoyang Chen, Wenliang Zhang, Fei Peng, Ting Cui, Guangdi Zhou, Zezhong Li, Jaewon Choi, Lizhi Xu, Yiu-Fung Chiu, Stefano Agrestini, Sahil Tippireddy, Haoliang Huang, Heng Wang, Xianfeng Wu, Peng Li, Jin-Feng Jia, Mirian Garcia-Fernandez, Yi Lu, Er-Jia Guo, Qi-Kun Xue, Zhuoyu Chen, Donglai Feng, Ke-Jin Zhou

Abstract: The recent discovery of Ruddlesden--Popper (RP) nickelate thin-film superconductors has opened a new frontier in unconventional superconductivity. Its realization requires both compressive epitaxial strain and highly oxidative growth conditions, yet the microscopic pathway from the parent phase to the superconducting phase remains elusive. Here, X-ray absorption spectra and resonant inelastic X-ra… ▽ More The recent discovery of Ruddlesden--Popper (RP) nickelate thin-film superconductors has opened a new frontier in unconventional superconductivity. Its realization requires both compressive epitaxial strain and highly oxidative growth conditions, yet the microscopic pathway from the parent phase to the superconducting phase remains elusive. Here, X-ray absorption spectra and resonant inelastic X-ray scattering are employed to track this evolution by independently tuning strain and oxygen content in (La,Pr)$_3$Ni$_2$O$_{7-δ}$ thin films. We uncover a remarkable two-step narrative. First, signatures of delocalization emerge in the same way upon two independent tunings: Spectral weight transfers from a ''Upper Hubbard''-like peak to the hole-like peak associated with O $2p_z$ state, and in parallel, the initially localized Ni $3d_{z^2}$ orbital becomes more itinerant followed by the broadening and weakening of $dd$ orbital excitations. Second, as itinerancy increases, long-range spin-density-wave (SDW) order is suppressed in both intensity and correlation length, indicating direct competition with superconductivity. Yet, short-range magnons persist: they become damped but their bandwidth stays unchanged. Our results paint a coherent picture that both strain and oxygenation drive the RP bilayer nickelates towards the superconducting instability, where the O $2p_z$ and Ni $3d_{z^2}$ orbitals become delocalized. Concomitantly, the long-range magnetic order loses coherence and gets suppressed. These findings establish an orbital-selective route to RP nickelate superconductivity, in which the delocalization of the $2p_z$ and $3d_{z^2}$ orbitals and the robust short-range magnons upon the melting of SDW order are prerequisites, providing strong constraints for theory and the roadmap for designing nickelate superconductors. △ Less

Submitted 24 April, 2026; v1 submitted 23 April, 2026; originally announced April 2026.

Comments: 9 pages, 4 figures

Seed Layer Engineering for Effective Charge Transfer Doping of MoS$_2$ Transistors

Authors: Sahej Sharma, Shao-Heng Yang, Himani Jawa, Rana Yuvraj, Bach Nguyen, Chang Niu, Shiva Radhakrishnan, Shalini Tripathi, Dennis Lin, Cesar Javier Lockhart de la Rosa, Pierre Morin, Dmitry Zemlyanov, Francesca Iacopi, Zhihong Chen, Joerg Appenzeller, Thomas E. Beechem

Abstract: Integrating two-dimensional semiconductors such as MoS$_2$ with dielectric materials remains a central challenge for their use in future logic technologies. While seed layers are typically introduced to promote dielectric nucleation and adhesion, we show that they also critically govern charge-transfer doping and, in turn, transistor performance. Back-gated monolayer MoS$_2$ transistors passivated… ▽ More Integrating two-dimensional semiconductors such as MoS$_2$ with dielectric materials remains a central challenge for their use in future logic technologies. While seed layers are typically introduced to promote dielectric nucleation and adhesion, we show that they also critically govern charge-transfer doping and, in turn, transistor performance. Back-gated monolayer MoS$_2$ transistors passivated on their top-surface with a Ta-seed/HfO$_x$ dielectric stack were fabricated and characterized electrically and physically using Raman, photoluminescence, and X-ray photoelectron spectroscopies. Threshold voltage and on-current varied strongly with Ta-seed thickness and deposition conditions, and these changes correlated with signatures observed across all spectroscopic probes. The results reveal that the seed layer both introduces disorder into the MoS$_2$ channel and modifies the interfacial charge environment controlling charge transfer between HfO$_x$ and MoS$_2$. Optical spectroscopy shows that on-current tracks seed-induced disorder, whereas X-ray photoelectron spectroscopy indicates that threshold voltage correlates with shifts in the local electrostatic environment associated with interfacial charge transfer. Better performance was obtained with ultrathin 0.2 nm Ta seed layers deposited under oxygen-poor conditions, which limit deposition-induced damage while facilitating charge transfer. These findings identify seed-layer engineering as a key strategy for controlling disorder and interfacial doping in MoS$_2$ devices and establish multimodal spectroscopy as a practical during-fabrication approach for process development and monitoring. △ Less

Submitted 4 June, 2026; v1 submitted 19 April, 2026; originally announced April 2026.

Comments: 27 pages, 7 figures

Spin-mediated hysteretic switching of unidirectional charge density waves by rotating magnetic fields

Authors: Zichao Chen, Shiyu Zhu, Kailin Xu, Ruwen Wang, Ningning Wang, Jianfeng Guo, Yunhao Wang, Xianghe Han, Zhongyi Cao, Jianping Sun, Hui Chen, Haitao Yang, Jinguang Cheng, Ziqiang Wang, Hong-Jun Gao

Abstract: Charge density waves (CDWs) are a widespread collective electronic order in quantum materials, furnishing key insights into symmetry breaking and competing phases. However, their dynamic control with external fields remains a pivotal challenge. Here, we report deterministic and hysteretic switching of unidirectional CDW orientation via in-plane magnetic field rotation in magnetic kagome metal GdTi… ▽ More Charge density waves (CDWs) are a widespread collective electronic order in quantum materials, furnishing key insights into symmetry breaking and competing phases. However, their dynamic control with external fields remains a pivotal challenge. Here, we report deterministic and hysteretic switching of unidirectional CDW orientation via in-plane magnetic field rotation in magnetic kagome metal GdTi3Bi4. Atomically resolved spectroscopy shows two types of 3a0*1a0 CDW domains, Q1 and Q2 oriented 60 degree apart along two distinct crystallographic directions and separated by atomically sharp domain walls. Rotating the magnetic field drives reversible transitions between these CDW configurations, exhibiting a robust C2-symmetric phase diagram with pronounced hysteresis. This hysteretic switching is mediated by a field-dependent reorientation of underlying antiferromagnetic spins, revealing a tunable energy landscape with stable and metastable states and modulates the electronic charge order via spin-lattice coupling. Our findings not only demonstrate the switching of CDW configurations by in-plane magnetic field but also reveal the mechanism of coupling between CDW and magnetic fields, offering new insights into CDW manipulation and versatile platform for developing a spin-mediated multistate spin-charge coupling memory and programmable quantum devices. △ Less

Submitted 15 April, 2026; originally announced April 2026.

Extreme Terahertz Nonlinear Phononics by Coherence-Imprinted Control of Hybrid Order

Authors: Liang Luo, Avinash Khatri, Martin Mootz, Tao Jiang, Liu Yang, Zijing Chen, Chuankun Huang, Zhi Xiang Chong, Joongmok Park, Ilias E. Perakis, Zhiwei Wang, Yugui Yao, Dao Xiang, Yong-Xin Yao, Jigang Wang

Abstract: Coherent control of quantum materials has progressed along two major fronts: nonlinear phononics, which reshapes lattices to induce emergent states, and Floquet engineering, which tailors electronic band reconstruction via time-periodic driving. Both mechanisms face fundamental limitations at terahertz (THz) frequencies: phononic nonlinearities are intrinsically weak in standard lattices, while el… ▽ More Coherent control of quantum materials has progressed along two major fronts: nonlinear phononics, which reshapes lattices to induce emergent states, and Floquet engineering, which tailors electronic band reconstruction via time-periodic driving. Both mechanisms face fundamental limitations at terahertz (THz) frequencies: phononic nonlinearities are intrinsically weak in standard lattices, while electronic Floquet states are often constrained by rapid decoherence upon light-off and by a scarcity of coherence-resolved, multi-correlation probes beyond (quasi-)stationary band structures. Here we report an extreme THz nonlinear-phononics mechanism in $\text{Ta}_\text{2}\text{NiSe}_\text{5}$, where a highly susceptible non-equilibrium electronic correlation bath dramatically amplifies lattice nonlinearities under coherent driving. Utilizing THz two-dimensional spectroscopy as a coherence-tomography tool, we resolve an exceptionally rich landscape of approximately 30 distinct multi-order quantum pathways, including high-harmonic phonon generation, multi-quantum coherences, and multi-wave anharmonic cross-mode mixing. The density and complexity of this extreme manifold establishes a new benchmark for THz nonlinear phononics, as the multi-order quantum pathways surpass the limits of conventional lattice responses. These high-order signals collapse above ~100~K, defining an electronic correlation scale of a coherence-imprinted hybrid electronic-phonon order that governs the sustainability of high-order quantum correlations and nonlinear pathways beyond linear and equilibrium responses. Our results establish a route for correlation-boosted, phonon-anchored periodic Hamiltonian engineering and for certifying such periodically-driven states via multi-correlation coherence tomography. △ Less

Submitted 14 April, 2026; originally announced April 2026.

Three-Dimensional Electronic Structures in Superconducting Ruddlesden-Popper Bilayer Nickelate Films

Authors: Yueying Li, Lizhi Xu, Wei Lv, Zihao Nie, Zechao Wang, Yu Miao, Jianchang Shen, Guangdi Zhou, Wenhua Song, Heng Wang, Haoliang Huang, Junfeng He, Jin-Feng Jia, Peng Li, Qi-Kun Xue, Zhuoyu Chen

Abstract: Beyond the quasi-two-dimensional (2D) paradigm of cuprates, the role of the third dimension of the Ruddlesden-Popper bilayer nickelates is essential to decoding their superconducting mechanism. Here, using angle-resolved photoemission spectroscopy (ARPES) with varied photon energies, we systematically investigate the electronic band structures in three dimensions for superconducting (La,Pr,Sm)… ▽ More Beyond the quasi-two-dimensional (2D) paradigm of cuprates, the role of the third dimension of the Ruddlesden-Popper bilayer nickelates is essential to decoding their superconducting mechanism. Here, using angle-resolved photoemission spectroscopy (ARPES) with varied photon energies, we systematically investigate the electronic band structures in three dimensions for superconducting (La,Pr,Sm)$_3$Ni$_2$O$_7$/SrLaAlO$_4$ thin films (superconducting onset temperature $T_c^{\text{onset}} \sim 48$ K) transferred via a cryogenic ultra-high vacuum suitcase. We reveal an orbital-dependent dimensionality: while the $d{x^2-y^2}$-dominant bands exhibit a quasi-2D character, the $d{z^2}$-dominant band displays a finite $k_z$ dispersion. Finite energy gaps are identified on all observed bands across multiple high-symmetry directions. Systematic temperature-dependent analysis characterizes the superconducting nature of the gap on the $d{z^2}$-derived band, revealing a large gap $Δ\sim 18$ meV and a ratio $2Δ/k_BT_c\sim 8$ exceeding the weak-coupling BCS limit. The suppression of spectral weight near the Fermi level persists above the superconducting transition temperature. Ubiquitous waterfall-like spectral features evidence the presence of electron interactions. These results underscore the role of the $d_{z^2}$ orbital and correlations, placing constraints on theoretical models for nickelate superconductivity. △ Less

Submitted 10 April, 2026; v1 submitted 9 April, 2026; originally announced April 2026.

Unveiling Mechanisms of SEI Formation and Sodium Loss in Sodium Batteries via Interface Reactor Sampling

Authors: Zhoulin Liu, Ziliang Wang, Zherui Chen, Jianchun Sha, Fengzijun Pan, Pingyang Zhang, Yinghe Zhang

Abstract: The solid electrolyte interphase SEI critically dictates the cyclability and Coulombic efficiency of sodium-metal batteries, yet its dynamic formation mechanisms and atomic-scale evolution during electrochemical cycling remain elusive due to the spatiotemporal limitations of existing techniques. Here, an "Interface Reactor" sampling strategy is proposed to construct a charge-aware neuroevolution p… ▽ More The solid electrolyte interphase SEI critically dictates the cyclability and Coulombic efficiency of sodium-metal batteries, yet its dynamic formation mechanisms and atomic-scale evolution during electrochemical cycling remain elusive due to the spatiotemporal limitations of existing techniques. Here, an "Interface Reactor" sampling strategy is proposed to construct a charge-aware neuroevolution potential (qNEP). This approach overcomes the instability bottlenecks of conventional machine learning potentials, enabling stable, first-principles-accurate molecular dynamics simulations of complex electrode-electrolyte interfaces on the hundred-nanosecond scale. Fundamentally distinct SEI formation mechanisms are revealed during the early stage: carbonate-based electrolytes form heterogeneous organic-inorganic matrices via "mixed co-formation," whereas ether-based electrolytes generate dense, self-limiting inorganic barriers through "surface-energy-controlled" NaF crystallization. Metadynamics simulations further elucidate that these compositional disparities govern sodium-ion storage dynamics: NaF-rich SEIs facilitate efficient metallic deposition, while carbonate-dominated interphases induce irreversible sodium trapping and continuous electrolyte decomposition. These findings establish a comprehensive atomic-scale framework linking solvation structure, interfacial reaction networks, and electrochemical performance, providing mechanistic guidelines for rational SEI engineering in next-generation alkali-metal batteries. Crucially, a general and robust computational framework is established for simulating complex interfacial reactions in electrochemical systems. △ Less

Submitted 8 April, 2026; originally announced April 2026.

ORION: Unifying Top-Down and Bottom-Up Chemical Space Sampling for a Universal Organic Force Field

Authors: Zherui Chen, Jiayu Zhang, Yuxuan Tian, Zhoulin Liu, Sining Dai, Yanghui Li, Cong Chen, Dingyuan Tang, Yajun Deng, Qingxia Liu

Abstract: Empirical force fields remain the primary tool for large-scale molecular simulation, yet their limited flexibility and transferability often hinder predictive modeling in chemically complex condensed-phase systems. Here we present ORION, a universal machine-learning force field for C, H, O, N, S, and P systems developed within the Neuroevolution Potential (NEP) framework. To enhance transferabilit… ▽ More Empirical force fields remain the primary tool for large-scale molecular simulation, yet their limited flexibility and transferability often hinder predictive modeling in chemically complex condensed-phase systems. Here we present ORION, a universal machine-learning force field for C, H, O, N, S, and P systems developed within the Neuroevolution Potential (NEP) framework. To enhance transferability across diverse chemical environments, ORION was trained on a chemically rich dataset constructed through an integrated top-down and bottom-up strategy, enabling accurate descriptions of complex organic configurations, reactive intermediates, and weak intermolecular interactions. ORION achieves near-density-functional-theory accuracy while retaining the efficiency required for large-scale molecular dynamics simulations. On the test set, it predicts atomic forces with substantially higher accuracy than ReaxFF while running 215.5 times faster under identical hardware conditions, making simulations on the hundreds-of-nanoseconds timescale readily accessible. The model provides a balanced description of bond breaking and formation, aromatic growth, hydrogen bonding, van der Waals interactions, and π-stacking, demonstrating strong transferability across both reactive and nonreactive systems. These results establish ORION as a practical and general force field for predictive simulations in chemistry and materials science, and provide an effective route toward universal machine-learning force fields with both high accuracy and broad applicability. △ Less

Submitted 7 April, 2026; originally announced April 2026.

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

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

Abstract: 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 pr… ▽ More 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. △ Less

Submitted 6 April, 2026; originally announced April 2026.

Fractal hierarchy enables exponential scaling of topological boundary states

Authors: Limin Song, Zhichan Hu, Ziteng Wang, Domenico Bongiovanni, Liqin Tang, Daohong Song, Roberto Morandotti, Jingjun Xu, Hrvoje Buljan, Zhigang Chen

Abstract: Exponential growth describes an extremely rapid process ubiquitous across mathematics and diverse physical, biological, and technological systems. Here, we introduce a class of fractal-inspired lattices that combine long-range periodic order with self-similar hierarchy, establishing a structural motif that enables exponential scaling of topological boundary states. We demonstrate this phenomenon i… ▽ More Exponential growth describes an extremely rapid process ubiquitous across mathematics and diverse physical, biological, and technological systems. Here, we introduce a class of fractal-inspired lattices that combine long-range periodic order with self-similar hierarchy, establishing a structural motif that enables exponential scaling of topological boundary states. We demonstrate this phenomenon in (i) a quasi-one-dimensional lattice chain constructed from Koch-curve unit cells and (ii) a two-dimensional periodic tiling lattice composed of Sierpinski-gasket unit cells. We show that, for suitable coupling parameters, both the number of topological boundary states $N_{\ell}$ and the number of topological minigaps $M_{\ell}$ grow exponentially with the fractal generation index $\ell$. We find that $N_{\ell}$ is an integer multiple of $M_{\ell}$, with the integer determined by the underlying symmetry. This hierarchical scaling law is captured by multi-topological-phase theory and confirmed experimentally in laser-written photonic lattices. Our results identify fractal hierarchy as a materials architecture principle for controlling boundary-state multiplicity, revealing an interplay between topology, self-similar geometry, and periodic order. More broadly, this work suggests a route to synthetic materials and integrated photonic platforms in which large numbers of robust boundary modes can be engineered within compact architectures. △ Less

Submitted 1 April, 2026; originally announced April 2026.

Comments: 17 pages, 4 figures

Pressure-enhanced superconductivity and its correlation with suppressed resistance dip in (La,Pr)3Ni2O7 films

Authors: Jinyu Zhao, Guangdi Zhou, Shu Cai, Shuaihang Sun, Yaqi Chen, Jing Guo, Yazhou Zhou, Haoliang Huang, Jin-Feng Jia, Yang Ding, Qi Wu, Zhuoyu Chen, Qi-Kun Xue, Liling Sun

Abstract: The discovery of superconductivity with a transition temperature (Tc) exceeding 40 K in La3Ni2O7 and (La,Pr)3Ni2O7 thin films at ambient pressure provides a viable platform for the experiments that can only be conducted under ambient-pressure conditions, and for the theoretical investigations aimed at understanding the commonalities and peculiarities of the behaviors related to the superconductivi… ▽ More The discovery of superconductivity with a transition temperature (Tc) exceeding 40 K in La3Ni2O7 and (La,Pr)3Ni2O7 thin films at ambient pressure provides a viable platform for the experiments that can only be conducted under ambient-pressure conditions, and for the theoretical investigations aimed at understanding the commonalities and peculiarities of the behaviors related to the superconductivity between the film and the compressed bulk systems - including the effects of oxygen vacancies and strain. Consequently, it is crucial to determine whether Tc can be further enhanced and to uncover the underlying physics that controls the Tc value in these ambient-pressure superconducting thin films. Here, we report a systematic study of hydrostatic pressure effects on the superconducting properties of (La,Pr)3Ni2O7 thin films. We find that external pressure universally enhances Tc of the film samples regardless of their initial Tc value. The onset Tc of 68.5 K at 2.0 GPa demonstrates a notable increase from 62 K at 0.3 GPa. Furthermore, we observe that the samples without zero resistance show a resistance dip just above the superconducting transition, whereas the samples that exhibit zero resistance do not display this dip. Applying pressure can suppress the dips and drive the system toward zero resistance. Based on our results, we propose that this feature is associated with oxygen vacancies and that the depth of the dip can serve as an indicator of the concentration of the vacancies. It is plausible that the dip is caused by the localization of mobile electrons at the vacancy sites. Applying pressure can delocalize these electrons, which in turn may contribute to the increase in Tc. △ Less

Submitted 31 March, 2026; originally announced March 2026.

Comments: 14 pages and 4 figures

Scanning tunneling microscopy study of helimagnetic monolayer CrBr2 on s-wave superconductor NbSe2: a topologically trivial system due to weak interfacial coupling

Authors: Yuanji Li, Ruotong Yin, Mingzhe Li, Shiyuan Wang, Jiashuo Gong, Ziyuan Chen, Jiakang Zhang, Dong-Lai Feng, Ya-Jun Yan

Abstract: Hybrid magnet-superconductor heterostructures attract significant interest for their potential to host unconventional superconductivity, topological superconductivity, and Majorana physics. Transition metal dihalides (MX2, M = transition metal, X = Cl, Br, I) are compelling magnetic candidates due to their novel magnetic structures and possible ferroelectricity. Here, we employ low-temperature sca… ▽ More Hybrid magnet-superconductor heterostructures attract significant interest for their potential to host unconventional superconductivity, topological superconductivity, and Majorana physics. Transition metal dihalides (MX2, M = transition metal, X = Cl, Br, I) are compelling magnetic candidates due to their novel magnetic structures and possible ferroelectricity. Here, we employ low-temperature scanning tunneling microscopy/spectroscopy to investigate the interfaces fabricated by growing helimagnet candidate CrBr2 on s-wave superconductor NbSe2. Our results reveal that the monolayer CrBr2 is insulating, the measured low-energy electronic states on it derive entirely from the NbSe2 substrate. The superconducting properties of CrBr2/NbSe2 are nearly identical to the bare NbSe2, manifested by the superconducting gap spectra and their temperature and magnetic field dependence, as well as the spatial distribution and bound states of magnetic vortices. Furthermore, in-gap excitations appear only at the dirty edges of CrBr2 islands and are absent from clean edges, suggesting the lack of intrinsic edge states. Taken together, these findings establish the topologically trivial nature of the helimagnetic insulator/s-wave superconductor system CrBr2/NbSe2, attributable to the absence of interfacial superconducting proximity and weak magnetic coupling. △ Less

Submitted 28 March, 2026; originally announced March 2026.

Comments: 12 pages, 4 figures

Journal ref: Phys. Rev. B 113, 094519 (2026)

Modulating nonlinear optical responses in 3R-MoS$_2$ Fabry-Pérot microcavities

Authors: Renkang Song, Ziye Chen, Junbo Xu, Zerui Wang, Zitao Wu, Shenao Zhao, Wenhao Su, Ziheng Pan, Junho Choi, Vasily Kravtsov, Di Huang, Zhanshan Wang, Tao Jiang

Abstract: Rhombohedrally stacked transition metal dichalcogenides such as 3R-MoS$_2$ offer an exceptional platform for nonlinear optics, naturally forming Fabry-Pérot (FP) microcavities due to their giant dielectric contrast with the surrounding media. However, rigorously tracking the evolution of multiple harmonic fields within these unpatterned monolithic crystals remains a fundamental challenge. Here, we… ▽ More Rhombohedrally stacked transition metal dichalcogenides such as 3R-MoS$_2$ offer an exceptional platform for nonlinear optics, naturally forming Fabry-Pérot (FP) microcavities due to their giant dielectric contrast with the surrounding media. However, rigorously tracking the evolution of multiple harmonic fields within these unpatterned monolithic crystals remains a fundamental challenge. Here, we establish a self-consistent framework, spanning from linear broadband reflectance to second- and third-harmonic generation (SHG and THG), to systematically decode these nonlinear behaviors. Moving beyond conventional models, we demonstrate that the nonlinear emission is dictated by a delicate interplay among the intrinsic material absorption, the FP effects at the fundamental frequency, as well as those at the harmonic frequencies. When harmonic photons lie below the bandgap, weak absorption allows the nonlinear spectra to exhibit a complex modulation driven by the synergistic contribution of FP effects from both fundamental and harmonic waves. In stark contrast, severe intrinsic absorption of higher-energy photons heavily damps the FP effects of the harmonic fields, reducing the nonlinear response to an absorption-limited regime modulated almost exclusively by the FP effects at the fundamental frequency. By successfully decoupling these geometric and material contributions across different harmonic orders, our findings provide a precise design paradigm for engineering next-generation van der Waals photonic architectures. △ Less

Submitted 26 March, 2026; originally announced March 2026.

Comments: 24 pages, 4 figures

SAM Molecular Stacking with Heterogeneous Orientationfor High-Performance Perovskite Photovoltaics

Authors: Lei Huang, Kai-Li Wang, Zhang Chen, Zhen-Huang, Saidjafar Murodzoda, Xin Chen, Jing Chen, Chun-Hao Chen, Yu Xia, Yu-Tong Yang, Jia-Cheng Li, Dilshod Nematov, Ilhan Yavuz, Zhao-Kui Wang

Abstract: This study demonstrates that thermal-evaporated SAM (eSAM) films, particularly in a thick configuration, spontaneously adopt a heterogeneous molecular orientation, forming a vertical-to-horizontal gradient in molecular packing. This unique architecture establishes a graded energy barrier, which is shown to facilitate more efficient hole transport compared with the single energy barrier presented b… ▽ More This study demonstrates that thermal-evaporated SAM (eSAM) films, particularly in a thick configuration, spontaneously adopt a heterogeneous molecular orientation, forming a vertical-to-horizontal gradient in molecular packing. This unique architecture establishes a graded energy barrier, which is shown to facilitate more efficient hole transport compared with the single energy barrier presented by conventional thin SAMs. In conclusion, while solution-processed SAMs present formidable scalability challenges, the thermal evaporation of SAMs offers a viable pathway toward industrial-scale fabrication. The strategy of employing thick eSAM films with gradient molecular packing not only circumvents the uniformity issues of solution methods but also introduces a superior structure for charge transport, positioning it as a promising enabler for the commercialization of high-efficiency perovskite photovoltaics. The inability to achieve uniform hole transport with solution-processed self-assembled monolayers (SAMs) constitutes a fundamental bottleneck for scaling perovskite photovoltaics. Herein, we demonstrate that thermal-evaporated SAMs (eSAMs) overcome this limitation by enabling precise thickness control. Crucially, a thickened eSAM spontaneously forms a vertical-to-horizontal gradient in molecular orientation, which creates a descending energy barrier that directionally facilitates hole transport. This tailored interface also ensures excellent surface coverage and directs the growth of high-quality perovskite films. Consequently, the resultant photovoltaic devices set new benchmarks, delivering impressive power conversion efficiencies (PCEs) of 21.46% (small-area, 0.108 cm2) and 19.38% (large-area module, 15.52 cm2) for fully vacuum-evaporated devices, while also setting an impressive PCE of 23.67% for eSAM-based devices with solution-processed perovskites. △ Less

Submitted 23 March, 2026; originally announced March 2026.

Journal ref: Chem, 2026, 12(3):102941