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2605.04693 2026-06-03 cond-mat.supr-con

Superconductivity in moiré transition metal dichalcogenide bilayers: comparison of two distinct theoretical approaches

莫尔过渡金属二硫族化物双层中的超导性:两种不同理论方法的比较

Waseem Akbar, Michał Zegrodnik

AI总结 本文通过负U-Hubbard模型和t-J-U模型两种互补理论方法,研究扭曲WSe2中的超导态,比较其关键性质并讨论实验意义。

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Journal ref
Acta Phys. Pol. B 57, 5-A12 (2026)
AI中文摘要

最近在莫尔过渡金属二硫族化物双层中观察到了超导性。这里,我们使用两种互补的理论方法研究扭曲WSe$_2$中的超导态。第一种基于负$U$-Hubbard模型,代表一种相对传统的配对场景,其中强电子-电子排斥不直接影响配对态,并出现各向同性的$s$波能隙。第二种方法采用$t$-$J$-$U$模型,允许非常规能隙对称性,并通过库仑排斥引起的实质性重整化纳入强关联效应。我们比较了这两种框架下获得的超导态的关键性质,并根据现有实验观测讨论了它们的含义。

英文摘要

Superconductivity has recently been observed in moiré transition-metal dichalcogenide bilayers. Here, we investigate the superconducting state in twisted WSe$_2$ using two complementary theoretical approaches. The first is based on the negative $U$-Hubbard model and represents a relatively conventional pairing scenario, in which strong electron-electron repulsion does not directly affect the paired state and an isotropic $s$-$wave$ gap emerges. The second approach employs the $t$-$J$-$U$ model, allowing for unconventional gap symmetries and incorporating strong correlation effects via substantial renormalization induced by Coulomb repulsion. We compare the key properties of the superconducting states obtained within these two frameworks and discuss their implications in light of available experimental observations.

2605.04633 2026-06-03 astro-ph.GA

A spectroscopic map of the Galactic centre: Integrated light and dynamical modelling

银河系中心的光谱图:集成光与动力学建模

A. Feldmeier-Krause, T. I. Maindl, G. van de Ven, S. Thater, P. Jethwa, I. Breda

AI总结 利用DYNAMITE代码对银河系中心内~3 pc x 66 pc区域的恒星视线运动学进行三轴轨道动力学建模,成功恢复Sgr A*质量并约束质量分布和轨道分布。

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Comments
11 pages (+ 5 pages Appendix), 9 (+ 5) figures, accepted A&A. Corrected typographical errors and incorporated language-editing suggestions. No changes to the scientific content or conclusions
AI中文摘要

银河系中心由一个包含超大质量黑洞Sgr A*的核星团占据。该星团嵌入在更大的周围核恒星盘中。这三个成分在不同径向尺度上主导银河系中心的质量预算。银河系中心的质量分布已通过观测单个亮星和各种动力学建模方法得到广泛研究。外部星系的情况不同,其观测通常仅限于视线方向积分运动学。对于此类系统,三轴轨道动力学建模已成为推导质量分布和恒星轨道分布的标准方法。我们旨在将这种方法应用于银河系中心并进行测试。我们提取了银河系中心内部~3 pc x 66 pc区域的恒星视线运动学图。我们使用DYNAMITE代码,该代码在给定引力势中计算轨道库并生成模型运动学图。然后将这些图与观测运动学图进行比较,从而约束银河系中心的引力势和轨道分布。我们恢复了Sgr A*的正确质量,我们的恒星质量分布与文献一致,尽管不确定性较大。恒星结构最多是轻微三轴的,接近扁球。内部区域的恒星轨道分布由动力学温暖和热轨道主导。在更大尺度上,动力学冷(高速旋转)轨道权重最大。热轨道和温暖轨道的优势是银河系中心内部动力学时标短的结果,导致动力学加热。大半径处冷轨道的存在可能归因于该区域较长的加热时标,以及外核恒星盘中的恒星更年轻。[删节]

英文摘要

The centre of the Milky Way is occupied by a nuclear star cluster that contains the supermassive black hole Sgr A*. The cluster is embedded in the larger surrounding nuclear stellar disc. These three components dominate the mass budget of the Galactic centre at different radial scales. The mass distribution of the Galactic centre has been studied extensively using observations of individual bright stars and various dynamical modelling approaches. The situation differs for external galaxies, where observations are often limited to the integrated line-of-sight kinematics. For such systems, triaxial orbit-based dynamical modelling has become a standard method of deriving mass distributions and stellar orbit distributions. We aim to apply and test this method on the Galactic centre. We extracted stellar line-of-sight kinematic maps of the inner ~3 pc x 66 pc region of the Galactic centre. We used the DYNAMITE code, which calculates an orbit library in a given gravitational potential and computes model kinematic maps. These maps were then compared to the observed kinematic maps, and the gravitational potential and orbit distribution of the Galactic centre were constrained. We recover the correct mass of Sgr A*, and our stellar mass distributions are in agreement with the literature, albeit with larger uncertainties. The stellar structures are at most mildly triaxial and close to oblate. The stellar orbit distribution in the inner region is dominated by dynamically warm and hot orbits. At larger scales, dynamically cold -- highly rotating -- orbits have the largest weights. The dominance of hot and warm orbits is a consequence of short dynamical timescales in the inner Galactic centre, causing dynamical heating. The presence of cold orbits at large radii may be explained by the longer heating timescales in this region, and by the stars in the outer nuclear stellar disc being younger.[abridged]

2606.03429 2026-06-03 stat.ME cond-mat.dis-nn cond-mat.stat-mech math-ph math.MP physics.data-an

Modeling Discrete Data with High-Order Vector Potts Models

高阶矢量Potts模型对离散数据的建模

Aaron De Clercq, Merijn Moody, Clélia de Mulatier

AI总结 本文通过引入q态自旋模型,将最大熵框架从二元数据推广到离散数据,提出高阶矢量Potts模型,并利用配分函数的圈展开和规范变换揭示其统计性质,最后聚焦于最小复杂模型实现快速模型选择。

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Comments
89 pages, 16 figures
AI中文摘要

对高维数据进行建模具有挑战性,但对于理解许多复杂系统至关重要。最大熵模型(如Ising模型和Potts模型)已被广泛用于从数据中的相关模式捕获成对相互作用,从而能够从观测(例如,从蛋白质序列或神经群体活动)中推断复杂系统的图形表示。最近,人们对涉及三个或更多变量的高阶相关模式建模的兴趣日益增长。虽然在高阶Ising模型的二元数据方面取得了进展,但我们将此框架扩展到更一般的离散数据情况。我们引入了q态自旋模型,这是一个完整的最大熵模型族,将矢量Potts模型推广到包含长程和任意高阶相互作用。在成对情况下,与标准矢量Potts模型相比,我们的模型允许更多样化的相互作用类型。我们通过示例讨论了它们的统计解释,并将其与离散傅里叶分析联系起来。利用配分函数的圈展开,我们证明了自旋模型的统计性质完全由其相互作用的代数结构所捕获。我们定义了规范变换,在此变换下该结构(以及配分函数)保持不变。规范变换下等价的模型可以被视为同一抽象统计模型的不同表示,尽管通常具有不同阶数的相互作用,这扩展了二元情况的结果。对于数据分析的实际应用,我们专注于二元情况下称为最小复杂模型的一个子集,并将其推广到离散数据。我们获得了这些模型边际似然的闭式表达式,从而能够快速进行模型选择。我们通过简单的真实世界示例说明了它们的用途。

英文摘要

Modeling high-dimensional data is challenging, yet essential to understanding many complex systems. Maximum entropy models such as Ising and Potts models have been used extensively to capture pairwise interactions from correlation patterns in data, allowing to infer graphical representations of complex systems from observations (e.g., from protein sequences or neural population activity). Recently, there has been growing interest in modeling higher-order correlation patterns involving simultaneously three or more variables. While progress has been made in binary data with high-order Ising models, we extend this framework to the more general case of discrete data. We introduce q-state spin models, a complete family of maximum entropy models that generalize the vector Potts model to include long-range and arbitrary high-order interactions. In the pairwise case, our models allow for more diverse interaction types compared to the standard vector Potts model. We discuss their statistical interpretation with examples and relate them to discrete Fourier analysis. Using a loop expansion of the partition function, we show that the statistical properties of spin models are fully captured by the algebraic structure of their interactions. We define gauge transformations under which this structure, and thus the partition function, remains invariant. Models equivalent under gauge transformations can be seen as different representations of the same abstract statistical model, despite generally having interactions of different orders, extending results from the binary case. For practical application to data analysis, we focus on a subset of models known in the binary case as Minimally Complex Models, generalizing them to discrete data. We obtain a closed-form expression for the marginal likelihood of these models, enabling fast model selection. We illustrate their use with simple real-world examples.

2606.03217 2026-06-03 stat.ML cond-mat.dis-nn cs.LG

An Asymptotic Theory of Chain-of-Thought in In-Context Learning

上下文学习中思维链的渐近理论

Kaito Takanami, Cengiz Pehlevan

AI总结 通过高维随机矩阵理论,推导了线性回归中上下文学习思维链的泛化误差精确公式,揭示了推理深度、预训练数据量和上下文长度之间的相变现象。

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AI中文摘要

思维链推理已成为一种广泛使用的机制,通过在推理时生成中间推理步骤来激发大型语言模型的多步推理。然而,泛化能力随思维链深度的缩放行为仍知之甚少。为了解决这个问题,我们研究了一个理论上可解的线性回归中上下文权重预测的思维链模型,其中测试时推理表示为权重参数估计的迭代细化。利用高维渐近下的随机矩阵理论工具,我们推导了泛化误差作为推理深度、预训练数据量和上下文长度的精确公式。我们的分析揭示了指数与多项式改进、饱和及过度思考之间的尖锐相变,并刻画了最优推理深度如何缩放。我们进一步表明,更深的推理在预训练和上下文信息足够丰富时最为有效,而有限的预训练或上下文会使较长的推理容易产生误差放大或饱和。我们还通过在完全学习的线性注意力和softmax注意力模型上的实验验证了这些预测。我们的结果为测试时思维链深度如何影响泛化提供了一个统一的理论解释。

英文摘要

Chain-of-thought (CoT) reasoning has become a widely used mechanism for eliciting multi-step reasoning in large language models by generating intermediate reasoning steps at inference time. Yet the scaling behavior of generalization with CoT depth remains poorly understood. To address this question, we study a theoretically solvable model of CoT for in-context weight prediction in linear regression, where test-time reasoning is represented as an iterative refinement of the weight-parameter estimate. Using tools from random matrix theory under high-dimensional asymptotics, we derive an exact formula for the generalization error as a function of reasoning depth, pretraining data amount, and context length. Our analysis reveals a sharp phase transition separating exponential and polynomial improvement, saturation, and overthinking, and characterizes how the optimal reasoning depth scales. We further show that deeper reasoning is most effective with sufficiently rich pretraining and in-context information, whereas limited pretraining or context makes longer reasoning prone to error amplification or saturation. We also validate these predictions through experiments on fully learned linear attention and softmax attention models. Our results provide a unified theoretical account of how test-time CoT depth affects generalization.

2606.03071 2026-06-03 q-bio.PE nlin.AO

Evolution of cooperation in two-level Prisoner's Dilemma

两层囚徒困境中合作的演化

Yaroslav Ispolatov, Michael Doebeli

AI总结 通过个体与群体两层博弈模型,研究空间结构群体中合作行为的演化,发现群体间动态(裂变与灭绝)是维持合作的关键,且局部选择比全局选择更有利于合作。

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Comments
20 pages 6 figures
AI中文摘要

我们考虑在空间设置下由群体结构种群进行的连续囚徒困境。种群动态包括个体层面的出生和死亡以及群体层面的裂变和灭绝事件。每个个体与其群体内的所有其他个体进行博弈,而群体则与其最近邻群体进行博弈。个体层面博弈的收益影响个体的出生率,群体层面博弈的收益影响群体的灭绝和裂变概率。我们表明,尽管群体内演化本身总是导致合作完全丧失,但由于特定的群体间动态,一定水平的合作得以维持。博弈的空间性质以及由此产生的裂变和灭绝事件对合作的演化至关重要:没有它们,合作永远不会维持。通过分析群体间裂变和灭绝事件的各种情景,我们发现当影响裂变和灭绝事件的选择是局部而非全局时,会演化出更高水平的合作。

英文摘要

We consider continuous Prisoner's Dilemma played in spatial setting by group-structured populations. The population dynamics consists of individual-level birth and death and group-level fission and extinction events. Each individual plays games with all other individuals within their group, while groups play games against their nearest neighbours. Payoffs from individual-level games affect birth rates of individuals, and payoffs from group-level games affect group extinction and fission probabilities. We show that a certain level of cooperation is maintained due to specific between-group dynamics even though the within-group evolution by itself always results in a complete loss of cooperation. The spatial nature of games and resulting fissioning and extinction events is essential for the evolution of cooperation: without it cooperation is never maintained. Analyzing various scenarios of between-group fission and extinction events, we find that higher levels of cooperation evolve when the selection affecting fission and extinction events is local rather than global.

2606.02840 2026-06-03 q-bio.PE cs.MA cs.NE nlin.AO

Self-Regulation through Communication in Evolved Neural Agents

进化神经代理中通过通信的自我调节

Joshua Nunley

AI总结 通过最小化捕食者回避任务,研究进化CTRNN代理中通信的自我调节功能,发现三种主要策略,其中自我调节呼叫依赖自我听觉维持逃避行为。

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Comments
7 pages, 5 figures. Submitted to ALIFE 2026
AI中文摘要

通信通常被理解为指示:从发送者向接收者传递信息的信号。我们提出了一个最小化捕食者回避任务,其中成对的进化CTRNN代理使用通信进行稳健生存,并且代理能听到自己的发声,如同自然系统。在来自2000多次进化运行的112个完美适应度代理中,出现了三种主导策略(占代理的81%):安全呼叫(39%),代理从安全隐蔽处发出信号;警报指示(22%),代理在威胁存在时发声而不依赖自我听觉;以及自我调节呼叫(20%),代理依赖听到自己的呼叫来维持逃避行为。在主动威胁期间呼叫的代理中,自我听觉依赖很常见(47%),但在仅到达安全隐蔽处后呼叫的代理中很少见(10%;p < 10^-4)。这种模式与因果顺序的差异一致:安全呼叫者先行动后通信,而自我调节呼叫者为了行动而通信。移除自我听觉选择性地损害自我调节呼叫者(适应度0.40),而安全呼叫者仍保持功能(0.90;p < 10^-9)。这些结果表明,通信可以进化以服务于呼叫者自身的行为调节,而不仅仅是向他人传递信息。

英文摘要

Communication is typically understood as indication: signals that transfer information from sender to receiver. We present a minimal predator avoidance task in which pairs of evolved CTRNN agents use communication for robust survival, and in which agents hear their own vocalizations, as in natural systems. Across 112 perfect-fitness agents from over 2,000 evolutionary runs, three dominant strategies emerge (accounting for 81% of agents): safety calling (39%), where agents signal from safe cover; alarm indication (22%), where agents vocalize when a threat is present without relying on self-hearing; and self-regulatory calling (20%), where agents depend on hearing their own call to sustain escape behavior. Self-hearing dependency is common among agents that call during an active threat (47%), but rare among agents that call only after reaching safe cover (10%; p < 10^-4). This pattern is consistent with a difference in causal order: safety callers act then communicate, while self-regulatory callers communicate in order to act. Removing self-hearing selectively impairs self-regulatory callers (fitness 0.40) while safety callers remain functional (0.90; p < 10^-9). These results show that communication can evolve to serve the caller's own behavioral regulation, not just information transfer to others.

2606.03936 2026-06-03 cs.LG physics.geo-ph

Correcting Neural Operator Spectral Bias via Diffusion Posterior Sampling with Sparse Observations

通过稀疏观测的扩散后验采样校正神经算子谱偏差

Niccolò Perrone, Fanny Lehmann, Stefania Fresca, Filippo Gatti

AI总结 提出FreqNO-DPS方法,利用扩散后验采样结合谱形状引导分数,校正神经算子在稀疏观测下的高频衰减谱偏差,实现近零谱偏差。

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AI中文摘要

神经算子代理(NO)比数值求解器快数个数量级地近似PDE解,但受谱偏差影响:高频内容被系统性地衰减,限制了在细尺度结构重要时的可靠性。通常也可获得场的稀疏传感器测量,提供点精度而无谱失真,但仅覆盖域的一小部分。我们通过将NO预测视为扩散后验采样框架中的辅助观测来解决这一问题。我们的方法FreqNO-DPS(此 https URL )将基于无条件分数扩散先验(在高保真模拟上训练)与扩散后验采样(DPS)相结合,以稀疏观测为条件并由冻结的神经算子引导。朴素集成会重新引入代理的谱偏差;我们通过一个闭式、谱形状的引导分数来解决这一问题,该分数根据代理的频率相关精度加权,且无需去噪器反向传播。一个无分布分析在频率-扩散-时间平面上界定了近似误差,并表明引导的频率依赖性无论分布假设如何都得以保持。在3D弹性波场预测中,传感器覆盖率为5%和2%时,该方法在所有频带上达到近零谱偏差,而代理和仅传感器DPS均显示出系统性的高频衰减。各向同性引导(自然基线)提高了点精度,但几乎完整地将偏差带入后验,证实了频率依赖性校准是必要的,而不仅仅是有益的。该框架仅需配对的代理/参考数据,且除了残差的近似谱对角性外,不利用任何问题特定结构,可通过我们提供的相干性诊断对新代理进行验证。

英文摘要

Neural operator surrogates (NO) approximate PDE solutions orders of magnitude faster than numerical solvers, but suffer from spectral bias: high-frequency content is systematically attenuated, limiting reliability where fine-scale structure matters. Sparse sensor measurements of the field are often available too, offering pointwise accuracy without spectral distortion but covering only a small fraction of the domain. We address this by treating NO predictions as auxiliary observations in a diffusion posterior sampling framework. Our method, FreqNO-DPS (https://github.com/niccoloperrone/FreqNO-DPS), combines an unconditional score-based diffusion prior, trained on high-fidelity simulations, with diffusion posterior sampling (DPS) conditioned on sparse observations and guided by a frozen neural operator. Naive integration reintroduces the surrogate's spectral bias; we resolve this with a closed-form, spectrally shaped guidance score that weights the surrogate by its frequency-dependent accuracy and needs no denoiser backpropagation. A distribution-free analysis bounds the approximation error across the frequency-diffusion-time plane and shows the guidance's frequency dependence is preserved regardless of distributional assumptions. On 3D elastic wavefield prediction at 5% and 2% sensor coverage, the method reaches near-zero spectral bias across all bands, where both the surrogate and sensor-only DPS show systematic high-frequency attenuation. Isotropic guidance, the natural baseline, improves pointwise accuracy but carries the bias into the posterior nearly intact, confirming that frequency-dependent calibration is essential, not merely beneficial. The framework needs only paired surrogate/reference data and exploits no problem-specific structure beyond the residual's approximate spectral diagonality, verifiable for new surrogates via the coherence diagnostic we provide.

2606.03919 2026-06-03 cs.SI cs.CY cs.DL cs.LG physics.soc-ph

Forecasting Conceptual Diffusion in Science: The Case of Quantum Computing

预测科学中的概念扩散:以量子计算为例

Thomas Maillart, Thibaut Chataing, David Dosu, Paul Bagourd, Julian Jang-Jaccard, Alain Mermoud

AI总结 通过构建时间分辨的概念共现网络并训练LightGBM模型,研究量子计算领域概念的内生巩固与外生扩散的可预测性,发现外生扩散和熵具有强可预测性(R²高达0.78),而内生巩固在量子计算中几乎不可预测,但在神经植入领域显著上升(R²=0.83),表明概念扩散受语义和引用环境中的稳定结构规律支配。

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Comments
19 pages, 5 figures, 6 tables. Code and manuscript sources: https://github.com/wazaahhh/breakthroughs-diffusion . An earlier version was presented at the Global Tech Mining Conference (GTM) 2026 (submission #117)
AI中文摘要

理解和预测科学变化需要能够区分科学概念的内生巩固和外生扩散的模型。利用OpenAlex中量子计算概念子树,我们构建了一个时间分辨的概念共现网络,并追踪每个概念对的上游引用谱系和下游扩散。我们在分布和多样性感知特征上训练LightGBM模型,以预测四个结果:内生巩固、外生扩散、它们的比率以及扩散熵。在控制科学整体出版增长后,内生巩固在主要的量子计算基准中基本不可预测。相比之下,外生扩散和熵具有很强的可预测性(R²高达0.78),并且由上游异质性、引用广度和分布离散度驱动,如SHAP分析所示;在机器人、先进材料和神经植入上的重复验证证实,外生扩散仍然是跨领域排名最高的目标(测试R²约0.60-0.87),而内生可预测性在神经植入中显著上升(测试R²=0.83),表明量子计算的不对称性并非普遍适用。案例研究表明,尖锐的熵增加与新概念前沿的开启同时发生,而熵崩溃则标志着技术趋同或范式更替。这些结果表明,概念扩散受嵌入语义和引用环境中的稳定结构规律支配。通过识别跨领域采纳的早期基于多样性的信号,该方法为快速发展的研究领域中的预期科学计量学、技术预见和创新导向政策分析提供了可扩展的基础。

英文摘要

Understanding and anticipating scientific change requires models that distinguish between endogenous consolidation and exogenous diffusion of scientific concepts. Using the quantum computing subtree of concepts in OpenAlex, we construct a temporally resolved concept co-occurrence network and track each concept pair through its upstream citation lineage and downstream diffusion. We train LightGBM models on distributional and diversity-aware features to predict four outcomes: endogenous reinforcement, exogenous diffusion, their ratio, and diffusion entropy. After controlling for overall publication growth of the scientific body, endogenous reinforcement proves largely unpredictable in the primary quantum-computing benchmark. In contrast, exogenous diffusion and entropy are strongly predictable ($R^2$ up to $0.78à) and are driven by upstream heterogeneity, citation breadth, and distributional dispersion, as shown by SHAP analyses; replications on robotics, advanced materials, and neuro implants confirm that exogenous diffusion remains the top-ranked target across fields ($R^2_test \sim 0.60-0.87$), while endogenous predictability rises markedly in neuro implants (R^2_test = 0.83), indicating that the quantum-computing asymmetry does not generalise uniformly. Case studies reveal that sharp entropy increases coincide with the opening of new conceptual frontiers, while entropy collapses signal technological convergence or paradigm displacement. These results demonstrate that conceptual diffusion is governed by stable structural regularities embedded in semantic and citation environments. By identifying early diversity-based signals of cross-domain uptake, the approach provides a scalable foundation for anticipatory scientometrics, technology foresight, and innovation-oriented policy analysis in rapidly evolving research fields.

2606.03864 2026-06-03 cs.SI cs.CY cs.DL cs.LG physics.soc-ph

Explainable Forecasting of Scientific Breakthroughs from Concept Network Dynamics

基于概念网络动力学的科学突破可解释预测

Thomas Maillart, Thibaut Chataing, Ntorina Antoni, David Dosu, Paul Bagourd, Julian Jang-Jaccard, Alain Mermoud

AI总结 提出一种可解释的机器学习方法,通过建模OpenAlex概念网络的演化,预测科学突破的结构前兆(研究概念之间联系的出现和增强),并利用59个特征的两阶段LightGBM模型同时预测概念对的形成和未来权重,在四个技术/生物医学领域取得优于现有方法的ROC-AUC(0.954-0.967)和可解释性。

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Comments
18 pages, 10 figures, 4 tables. An earlier version was presented at Global Tech Mining Conference 2026. Code and data: https://github.com/wazaahhh/breakthroughs-forecasting
AI中文摘要

我们介绍了一种可解释的机器学习方法,通过建模OpenAlex概念网络随时间演化的方式,预测科学突破的结构前兆——研究概念之间联系的出现和增强。利用59个语义和拓扑特征,一个两阶段LightGBM模型联合预测概念对的形成及其未来权重,增加了一个回归阶段,将预期强度量化到先前的链接存在预测之上。与现有技术相比,该方法同时提高了准确性和可解释性:在四个技术和生物医学领域的比较验证中,无需重新调整即可在所有时间范围内获得[0.954, 0.967]的ROC-AUC,超过了先前模型约0.90的水平,而每个预测都基于结构化的、可审计的特征,而非不透明的嵌入。分类性能高(AUC约0.95),回归保持稳定(一到五年内RMSLE为0.45至0.6)。特征归因表明,结构因素——特别是Adamic-Adar相似性和基于度的Hadamard度量——持续驱动准确性,表明与突破相关的重组出现在紧密连接的子网络中。两个专家锚定的案例——量子退火和AI赋能的量子架构——显示模型浮现出与专家预期一致的技术融合。然后,我们概述了一个三层决策架构——检测、专家翻译、机构整合——将这些预测转化为基于证据的研究战略和政策,以开放数据和可解释特征为基础。

英文摘要

We introduce an explainable machine-learning approach that forecasts the structural precursors of scientific breakthroughs -- the emergence and intensification of links between research concepts -- by modelling how OpenAlex concept networks evolve over time. Using 59 semantic and topological features, a two-stage LightGBM model jointly predicts the formation and the future weight of concept pairs, adding a regression stage that quantifies expected intensity to prior link-existence forecasts. Relative to the state of the art, the approach improves accuracy and explainability at once: comparative validation across four technology and biomedical domains yields ROC-AUC in [0.954, 0.967] at all horizons without re-tuning, exceeding the roughly 0.90 of prior models, while every forecast rests on structural, auditable features rather than opaque embeddings. Classification performance is high (AUC about 0.95) and regression remains stable (RMSLE 0.45 to 0.6 over one to five years). Feature attribution shows that structural factors -- particularly Adamic-Adar similarity and degree-based Hadamard measures -- consistently drive accuracy, suggesting that breakthrough-relevant recombinations emerge in tightly connected sub-networks. Two expert-anchored cases, quantum annealing and AI-enabled quantum architectures, show the model surfacing technological convergence consistent with expert expectations. We then outline a three-layer decision architecture -- detection, expert translation, institutional integration -- that turns these forecasts into evidence-based research strategy and policy, anchored in open data and explainable features.

2606.03584 2026-06-03 cs.LG cond-mat.dis-nn cs.NE

Training a Predictive Coding Network on ImageNet using Equilibrium Propagation

使用均衡传播在ImageNet上训练预测编码网络

Tugdual Kerjan, Rasmus Høier, Benjamin Scellier

AI总结 提出一种结合中心化均衡传播与新型均衡方案的预测编码网络训练方法,在ImageNet上训练10层卷积PCN,达到13.23% top-5错误率,接近反向传播基线。

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AI中文摘要

均衡传播(EP)是一种基于物理的训练框架,主要应用于能量模型,包括连续Hopfield网络、非线性电阻网络和耦合相位振荡器。然而,EP的实际应用至今仍局限于相对小规模的问题。预测编码网络(PCN)是另一类根植于计算神经科学的能量模型,通常使用专门的算法训练,同样尚未在大规模上得到验证。在这项工作中,我们开发了一种基于EP的PCN训练方法,该方法将中心化EP与一种新的PCN均衡方案相结合。使用这种方法,我们在全尺寸ImageNet上训练了一个10层卷积PCN(VGG10),在top-5分类任务上实现了13.23%的测试错误率,接近12.2%的反向传播基线。据我们所知,这是PCN和基于EP的训练首次在ImageNet规模上得到验证。这些结果显著扩展了两种方法的可扩展性,并表明在其他物理系统中扩展EP的主要挑战可能更多地来自这些系统的计算特性,而非EP框架本身的固有限制。

英文摘要

Equilibrium Propagation (EP) is a physics-based training framework that has primarily been employed in energy-based models, including continuous Hopfield networks, nonlinear resistive networks and coupled phase oscillators. However, EP's practical applications have so far remained limited to relatively small-scale problems. Predictive coding networks (PCNs), another class of energy-based models rooted in computational neuroscience, are typically trained with a specialized algorithm and have likewise not yet been demonstrated at large scale. In this work, we develop an EP-based training method for PCNs which combines the centered variant of EP with a novel equilibration scheme for PCNs. Using this approach, we train a 10-layer convolutional PCN (VGG10) on full-size ImageNet, achieving 13.23\% test error rate on the top-5 classification task, close to the 12.2\% backpropagation baseline. To our knowledge, this is the first demonstration of both PCNs and EP-based training at ImageNet scale. These results significantly extend the scalability of both approaches and suggest that the primary challenges in scaling EP in other physical systems may come more from the computational properties of these systems than from inherent limitations of the EP framework.

2606.03515 2026-06-03 cs.CE cs.NA math.NA quant-ph

A Voxel-Based Quantum Computing Method (VBQC) for Solid Mechanics Problem

基于体素的量子计算方法(VBQC)用于固体力学问题

Feng Wu, Yuxiang Yang, Li Zhu, Chen Li, Yansong Guo, Xu Guo

AI总结 提出一种基于体素的量子计算方法(VBQC),通过体素网格离散化使系统矩阵具有三对角分形性质,并利用KCQ分解结合量子傅里叶变换和量子多路复用器实现固体力学中哈密顿量的高效量子模拟。

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AI中文摘要

量子计算为克服大规模力学问题中的效率和内存限制提供了一种有前景的方法,在流体力学中已展示了许多成功应用。然而,由于拉格朗日公式和复杂边界,固体力学问题通常需要不规则网格进行空间离散化,这使得系统矩阵(例如质量矩阵或刚度矩阵,在量子计算中常被称为哈密顿量)的量子模拟难以有效进行。本研究提出了一种基于体素的量子计算方法(VBQC),用于固体力学中哈密顿量的量子模拟。VBQC应用体素网格对空间域进行离散化,从而使系统矩阵具有三对角分形性质。基于这一性质,系统矩阵可以分解为三组基本矩阵:$\mathbf{k}_{n}$、$\mathbf{c}_{n}$和$\mathbf{q}_{n}$。这一分解过程称为KCQ分解。通过将KCQ分解与量子傅里叶变换和量子多路复用器相结合,VBQC能够高效地实现固体力学中哈密顿量的量子模拟。应用了三个不同维度和变量数量的具体固体问题,初步验证了所提出的VBQC在固体力学问题中的正确性。

英文摘要

Quantum computing presents a promising method to overcome the efficiency and memory constraints in large-scale mechanical problems, with numerous successful applications demonstrated in fluid mechanics. However, solid mechanics problems usually require irregular grids for spatial discretization, due to the Lagrange formulations and complex boundaries, which makes the quantum simulation of the system matrix, e.g., the mass or stiffness matrix which is often referred to as the Hamiltonian in quantum computing, difficult to be effectively conducted. This study proposes a voxel-based quantum computing method (VBQC) for the quantum simulation of Hamiltonians in solid mechanics. VBQC applies voxel grids to discretize the spatial domain, thereby enabling the system matrix to exhibit the tridiagonal fractal property. Based on this property, the system matrix can be decomposed into three groups of fundamental matrices, $\mathbf{k}_{n}$, $\mathbf{c}_{n}$, and $\mathbf{q}_{n}$. This decomposition process is referred to as the KCQ decomposition. By integrating the KCQ decomposition with the quantum Fourier transform and the quantum multiplexer, VBQC enables efficient quantum simulation of Hamiltonians in solid mechanics. Three specific solid problems with different dimensions and numbers of variables are applied to preliminarily verify the correctness of the proposed VBQC for solid mechanics problems.

2606.03249 2026-06-03 cs.CC quant-ph

Quantum-Classical Equivalence for AND-Functions

AND函数的量子-经典等价性

Sreejata Kishor Bhattacharya, Farzan Byramji, Arkadev Chattopadhyay, Yogesh Dahiya, Shachar Lovett

AI总结 通过证明任意布尔函数f的AND组合f∘AND_2的有界误差量子通信复杂性与经典确定性通信复杂性多项式相关(至多对数因子),解决了关于AND函数量子通信优势的长期猜想。

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AI中文摘要

量子通信复杂性中的一个主要开放问题是,对于计算全布尔函数,量子协议是否可能比经典协议指数级更高效;普遍猜想认为不可能。在一项开创性工作中,Razborov (2002) 通过证明当外层函数$f$对称时,形如$$ F(x,y) = f(x_1 \land y_1, \ldots, x_n \land y_n) $$的AND函数的有界误差量子与经典通信复杂性是多项式相关的,从而解决了该问题。此后,将此结果推广到所有AND函数一直悬而未决,并被多位作者提出。在本工作中,我们以强有力的方式解决了这个问题。我们证明,对于任意布尔函数$f$,函数$f \circ \mathrm{AND}_2$的有界误差量子与经典确定性通信复杂性是多项式相关的,至多相差$n$的多对数因子。我们通过证明两者——至多多项式损失——均由$f$的德摩根稀疏性的对数刻画来证明这一点。我们的结果建立在Chattopadhyay、Dahiya和Lovett (2025) 关于非稀疏布尔函数结构刻画的最新工作之上,我们将其推广以解决一般AND函数的猜想。

英文摘要

A major open problem in quantum communication complexity is whether quantum protocols can be exponentially more efficient than classical protocols for computing total Boolean functions; the prevailing conjecture is that they cannot be so. In a seminal work, Razborov (2002) resolved this question for AND-functions of the form $$ F(x,y) = f(x_1 \land y_1, \ldots, x_n \land y_n), $$ when the outer function $f$ is symmetric, by proving that their bounded-error quantum and classical communication complexities are polynomially related. Since then, extending this result to all AND-functions has remained open and has been posed by several authors. In this work, we settle this problem in a strong way. We show that for every Boolean function $f$, the bounded-error quantum and classical deterministic communication complexities of the function $f \circ \mathrm{AND}_2$ are polynomially related, up to polylogarithmic factors in $n$. We prove this by showing that both are characterized--up to polynomial loss--by the logarithm of the De Morgan sparsity of $f$. Our results build on the recent work of Chattopadhyay, Dahiya, and Lovett (2025) on structural characterizations of non-sparse Boolean functions, which we extend to resolve the conjecture for general AND-functions.

2606.03199 2026-06-03 cs.LG physics.chem-ph

Fast Organic Crystal Structure Prediction with Unit Cell Flow Matching

基于晶胞流匹配的快速有机晶体结构预测

Alston Lo, Luka Mucko, Austin H. Cheng, Andy Cai, Alastair J. A. Price, Wojciech Matusik, Alán Aspuru-Guzik

AI总结 提出Clari模型,利用流匹配生成无冗余晶胞,以秒级速度实现有机晶体结构预测,速度提升15-30倍。

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AI中文摘要

有机晶体结构预测(CSP)是有机固体计算建模的必要条件,但传统上每个分子需要耗费数CPU年。诸如OXtal之类的生成模型通过直接采样稳定的有机晶体结构,大幅降低了这一成本。然而,OXtal放弃了显式晶格参数化,转而使用昂贵的三角形层对块体材料的大块区域进行建模,这可能导致每个分子花费数分钟的计算成本。在本文中,我们通过Clari将其降低到秒级,Clari是一个大规模流匹配模型,生成无冗余晶胞,并用纯对偏注意力取代三角形层。Clari仅需原子类型和键作为输入,无需RDKit可处理的输入分子,从而扩展了其适用于富勒烯、金属配合物和原子团簇等具有挑战性的化学体系。我们进一步消融了关键设计选择,如辅助损失、时间步分布、噪声先验和自条件化。在OXtal的测试集上,我们超越了OXtal的求解率,同时获得了15-30倍的加速。由于Clari还模拟了显式氢原子,它通过直接能量排序支持推理时扩展,无需任何修饰或弛豫步骤。当生成150个晶体并选择能量前30的晶体时,我们进一步提高了求解率,同时保持了5-8倍的加速。我们还引入了CSD教学子集,作为未来基准测试中多样化和复杂分子的新测试分割。我们的贡献使得在几秒内实现CSP成为可能,使有机固体的大规模虚拟筛选变得实用。代码可从此https URL获取。

英文摘要

Organic crystal structure prediction (CSP) is a requirement for computational modelling of organic solids, but traditionally costs several CPU-years per molecule. Generative models such as OXtal dramatically reduce this cost by sampling stable organic crystal structures directly. However, OXtal forgoes explicit lattice parametrization in favour of modelling large crops of the bulk material with expensive triangle layers, which can incur a computational cost of minutes per molecule. In this paper, we reduce this to seconds with Clari, a large-scale flow matching model that generates redundancy-free unit cells and replaces triangle layers with pure pair-bias attention. Clari requires only atom types and bonds as input and does not need an RDKit-sanitizable input molecule, which expands its applicability to challenging chemistries such as fullerenes, metal complexes, and atom clusters. We further ablate key design choices such as auxiliary losses, timestep distributions, noise priors, and self-conditioning. On OXtal's test sets, we surpass OXtal's solve rate while obtaining a speedup of $15$-$30\times$. Because Clari also models explicit hydrogens, it supports inference-time scaling via direct energy ranking, without any decoration or relaxation step. When generating 150 crystals and selecting the top-30 by energy, we further improve solve rate while maintaining a speedup of $5$-$8\times$. We also introduce the CSD Teaching Subset as a new test split of diverse and complex molecules for future benchmarking. Our contributions enable CSP within seconds, making large-scale virtual screening of organic solids practical. Code is available at https://github.com/aspuru-guzik-group/clari.

2606.03038 2026-06-03 cs.LG physics.comp-ph physics.optics

Will Accurate Fields Mislead Photonic Design? FromGlobal Accuracy to Port Readout

精确的场会误导光子设计吗?从全局精度到端口读出

Yitian Zhang, Yonghong chen, Youming Chen, Yiyang Li, Xing Zhe, Renhe Lu, Shaolin Liao, Yuzhe Ma, Zhong Guan

AI总结 针对光子设计中全局场精度高但端口读出不可靠的问题,提出传播对齐神经算子PaNO及其输出感知变体PaNO-R2,在MMI分束器基准上将端口功率误差降低72.7%。

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AI中文摘要

神经场代理可以加速光子设计循环,但一个在全局场误差上看起来精确的代理,当最终决策依赖于局部输出端口读出时,仍可能对候选器件进行错误排序。这种风险在传播主导的MMI分束器和耦合器中尤为严重,其中端口功率、分束、相位和耦合由累积的模态干涉和输出窗口聚合决定,而不仅仅是平均场相似性。我们通过场/中介/读出视角研究这种场到设计的不匹配,将密集复场误差与传播轮廓和输出窗口误差在端口聚合前分离。为了将代理与此链对齐,我们提出PaNO,一种传播对齐的神经算子,它保持全场预测接口,同时围绕局部边界结构、横向模态内容、轴向传播和交叉模态交互组织潜在状态。我们还评估了PaNO-R2,一种针对端口区域附近残余场分量的输出感知反馈变体。在具有4608个保留场的15波长可调谐$3\times3$ MMI基准上,PaNO将NeurOLight的端口功率误差从0.2018降低到0.0739,尽管cMAE略有升高,表明仅全局场精度不足以实现设计相关的读出保真度。PaNO-R2获得了最佳的cMAE、传播轮廓误差、输出轮廓误差和端口功率误差,将NeurOLight的端口功率和输出轮廓误差分别降低了72.7%和72.5%。

英文摘要

Neural field surrogates can accelerate photonic design loops, but a surrogate that looks accurate in global field error can still mis-rank candidate devices when the final decision depends on localized output-port readouts. This risk is acute in propagation-dominated MMI splitters and couplers, where port power, splitting, phase, and coupling are determined by accumulated modal interference and output-window aggregation rather than by average field similarity alone. We study this field-to-design mismatch through a Field/Mediator/Readout view that separates dense complex-field error from propagation-profile and output-window errors before port aggregation. To align the surrogate with this chain, we propose PaNO, a propagation-aligned neural operator that keeps the full-field prediction interface while organizing latent states around local boundary structure, transverse modal content, axial propagation, and cross-mode interaction. We also evaluate PaNO-R2, an output-aware feedback variant for residual field components near the port region. On a 15-wavelength tunable $3{\times}3$ MMI benchmark with 4608 held-out fields, PaNO lowers NeurOLight's port-power error from 0.2018 to 0.0739 despite slightly higher cMAE, showing that global field accuracy alone is not sufficient for design-relevant readout fidelity. PaNO-R2 attains the best cMAE, propagation-profile error, output-profile error, and port-power error, reducing NeurOLight's port-power and output-profile errors by 72.7\% and 72.5\%.

2606.02813 2026-06-03 cs.GT cs.MA cs.SI physics.soc-ph

Democracy on Rugged Landscapes: Phase Transitions in Optimal Voting Rules

崎岖景观上的民主:最优投票规则的相变

Joshua Nunley

AI总结 通过NK适应度景观模型研究集体治理,发现直接民主下最优投票方法随景观复杂度发生尖锐相变,并引入代议制民主模型分析代表性对复杂度依赖结构的影响。

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Comments
8 pages, 3 figures. Submitted to ALIFE 2026
AI中文摘要

法律和制度通过与公民多样化环境的复杂互动塑造个人结果,然而不同投票方法如何驾驭这种耦合景观仍知之甚少。我们将集体治理建模为NK适应度景观上的优化,其中共享位(法律)通过投票更新,而个体位(个人特征)保持不变。交叉依赖参数$\alpha$控制立法效果对个人情况的依赖程度。我们比较了八种标准投票方法和一个广义评分族,景观崎岖度$K \in \{1,\ldots,20\}$和$\alpha \in [0,1]$,每种配置运行1000次。在直接民主下,最优投票方法随景观复杂度发生尖锐相变:基数评分投票在平滑景观上占优,序数评分($p=0.35$)在低到中等崎岖度下占优,波达计数在广泛中间范围内占优,STAR投票在最高复杂度下占优。一个双参数经验公式将$(K, \alpha)$平面简化为单一复杂度轴以便可视化。波达计数在参数空间大部分区域实现最高平均适应度和最低方差。我们进一步引入由身份权重$\beta$和候选人自利性$p_{\mathrm{self}}$参数化的代议制民主模型。即使在有利条件下,代表性重塑了复杂度依赖结构:基数评分投票在大多数制度下占优,而简单多数制在$\beta$高且$p_{\mathrm{self}}$低到中等时成为最优方法。

英文摘要

Laws and institutions shape individual outcomes through complex interactions with citizens' diverse circumstances, yet how different voting methods navigate this coupled landscape remains poorly understood. We model collective governance as optimization on NK fitness landscapes, where shared bits (laws) are updated by voting while individual bits (personal traits) remain fixed. A cross-dependency parameter $α$ controls how legislation's effects depend on individual circumstances. We compare eight standard voting methods and a generalized scoring family across landscape ruggedness $K \in \{1,\ldots,20\}$ and $α\in [0,1]$ with 1000 runs per configuration. Under direct democracy, the optimal voting method undergoes sharp phase transitions as a function of landscape complexity: cardinal score voting dominates on smooth landscapes, ordinal scoring with $p=0.35$ at low-to-moderate ruggedness, Borda count across a wide middle range, and STAR voting at the highest complexity. A two-parameter empirical formula reduces the $(K, α)$ plane to a single complexity axis for visualization. Borda count achieves the highest mean fitness and lowest variance across most of the parameter space. We further introduce a representative democracy model parameterized by identity weight $β$ and candidate self-interest $p_{\mathrm{self}}$. Representation reshapes the complexity-dependent structure even under favorable conditions: cardinal score voting dominates across most regimes, with plurality emerging as the top method at high $β$ and low-to-moderate $p_{\mathrm{self}}$.

2606.02785 2026-06-03 cs.LG hep-ex physics.atom-ph quant-ph

QUIVER: Quantum-Informed Views for Enhanced Representations in Large ML Models

QUIVER: 用于大型机器学习模型中增强表示的量子信息视角

Aritra Bal, Michael Binder, Markus Klute, Benedikt Maier, Michael Spannowsky

AI总结 提出QUIVER框架,通过变分量子电路提取量子Fisher信息矩阵作为几何特征,与经典特征融合以提升大型机器学习模型性能,并在QM9和JetClass数据集上验证了有效性。

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Comments
9 pages, 1 figure and 2 tables. Accepted as a poster at the AI4Physics Workshop, ICML 2026 (Seoul, South Korea)
AI中文摘要

大型机器学习模型显著受益于提供同一示例互补视角的多模态输入。我们引入QUIVER(量子信息增强表示视角),这是一种用量子Fisher视角丰富经典数据驱动特征的范式:量子Fisher视角是一种几何驱动的、基无关的高阶相关性总结,由为执行相同任务而训练的变分量子电路(VQC)捕获。与经典特征增强不同,量子Fisher信息矩阵编码了学习到的量子态流形的内在几何结构。虽然这种受量子信息理论启发的特征映射通常难以经典建模,但它可以揭示额外的经典数据或模型容量难以学习的统计结构。这使得量子Fisher视角成为一种真正互补而非冗余的模态。我们证明QUIVER在两个来自完全不同领域的基准数据集上提升了标准性能指标:用于预测分子性质的QM9,以及用于预测大型强子对撞机(LHC)喷注风味的JetClass。然而,核心贡献是领域无关的:量子Fisher视角可以通过对基础架构进行针对性修改,融合到广泛类别的模型架构中,以纳入问题的量子几何信息。这些结果表明,从模拟变分电路中提取的量子几何特征,可以在容错量子硬件出现之前,为标准机器学习任务带来可衡量的价值。

英文摘要

Large machine learning models benefit substantially from multimodal inputs that provide a complementary view of the same example. We introduce QUIVER (QUantum-Informed Views for Enhanced Representations, a paradigm that enriches classical data-driven features with a quantum Fisher view: a geometrically motivated, basis-independent summary of higher-order correlations captured by a variational quantum circuit (VQC) trained to perform the same task. Unlike classical feature augmentation, the quantum Fisher information matrix encodes the intrinsic geometry of the learned quantum state manifold. While this feature map, motivated by quantum information theory, is ordinarily non-trivial to model classically, it can surface statistical structure that additional classical data or model capacity finds difficult to learn. This makes the quantum Fisher view a genuinely complementary modality rather than a redundant one. We demonstrate that QUIVER improves standard performance metrics on two benchmark datasets from very different fields: QM9 for predicting molecule properties, and JetClass for predicting jet flavor at the Large Hadron Collider (LHC). The core contribution, however, is domain-agnostic: the quantum Fisher view can be fused into a broad class of model architectures via targeted modifications to the base architecture, to incorporate information about the quantum geometry of the problem. These results demonstrate that quantum-geometric features, extracted from simulated variational circuits, can deliver measurable value for standard machine learning tasks, well before the advent of fault-tolerant quantum hardware.

2606.02764 2026-06-03 cs.CV physics.comp-ph

From Local Training to Large-Scale Mapping: A Comparative Assessment of Machine Learning and Deep Learning for Transferable Satellite-Derived Bathymetry

从局部训练到大规模制图:机器学习与深度学习在可迁移卫星测深中的比较评估

Hsiao-Jou Hsu, Joachim Moortgat

AI总结 本研究评估了随机森林与四种CNN在0-20米深度范围内基于Sentinel-2影像的可迁移卫星测深性能,通过保持空间连续性的训练策略和引入平滑权重函数损失,实现了跨区域稳健的深度估计。

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Journal ref
Remote Sens. 18 (2026) 1768
Comments
42 pages, 13 figures, 15 tables. Supplementary Information provided as ancillary file (anc/SI.pdf). Code and pretrained weights at https://github.com/buckai-observatory/DL_bathy
AI中文摘要

多光谱影像的卫星测深(SDB)成本效益高,但在不同区域间的扩展性较差,尤其是在光学复杂的沿海环境中。我们利用Sentinel-2影像评估了机器学习与深度学习在0-20米深度范围内的可迁移SDB性能。在普拉塔斯岛和大堡礁选定区域训练了随机森林基线模型和四种CNN(ResNet-50、ResNet-101、EfficientNet-B4、ConvNeXt-Large),然后在空间独立的区域内和跨区域测试区域进行评估。训练过程中保持空间连续性(即保留连续的礁块而非随机斑块)是影响最大的设计选择;我们进一步引入了平滑权重函数(SWF)加权的RMSE损失,以强调近地表深度。采用这些选择后,区域内RMSE在0-20米范围内为1.15至1.92米,在深度≤3米时低至0.26米。随机森林在跨区域迁移下性能急剧下降(RMSE从1.53米升至2.99-3.78米),而深度模型保持更稳健(2.46-2.98米)。在公开的MagicBathyNet航空RGB基准(0-16米)上,所提出的网络达到了0.19-0.22米的RMSE,优于U-Net基线和一种任务特定的Transformer架构,且参数显著更少。我们进一步利用了多时相重复影像:在其上训练增加了多样性,并且在推理时对各次通过的中位数聚合预测减少了来自太阳角度、大气条件、水性质和潮汐变化的噪声。我们发布了优化的架构和预训练权重,以实现对新地点的可扩展迁移。

英文摘要

Satellite-derived bathymetry (SDB) from multispectral imagery is cost-effective but scales poorly across regions, especially in optically complex coastal environments. We evaluate machine learning and deep learning for transferable SDB over the 0-20 m depth range using Sentinel-2 imagery. A Random Forest baseline and four CNNs (ResNet-50, ResNet-101, EfficientNet-B4, ConvNeXt-Large) are trained on Pratas Island and selected Great Barrier Reef regions, then evaluated on spatially independent intra- and cross-regional test areas. Preserving spatial continuity during training, by keeping contiguous reef blocks rather than random patches, is the single most impactful design choice; we further introduce a Smooth Weight Function (SWF)-weighted RMSE loss that emphasizes near-surface depths. With these choices, intra-regional RMSE ranges from 1.15 to 1.92 m over 0-20 m and is as low as 0.26 m for depths <= 3 m. Random Forest degrades sharply under cross-regional transfer (RMSE 1.53 m -> 2.99-3.78 m), while the deep models stay more robust (2.46-2.98 m). On the public MagicBathyNet aerial-RGB benchmark (0-16 m) the proposed networks reach 0.19-0.22 m RMSE, outperforming a U-Net baseline and a task-specific transformer architecture with substantially fewer parameters. We further exploit multi-temporal repeat imagery: training on it broadens diversity, and median-aggregating predictions across passes at inference reduces noise from changing sun angles, atmospheric conditions, water properties, and tides. We release optimized architectures and pretrained weights to enable scalable transfer to new sites.

2606.02662 2026-06-03 cs.LG cs.AI physics.chem-ph

Improvise, Adapt, Overcome: An On-The-Fly Multifidelity Algorithm for Efficient Machine Learning

即兴、适应、克服:一种用于高效机器学习的即时多保真算法

Vivin Vinod, Peter Zaspel

AI总结 提出一种自适应即时多保真机器学习框架,通过动态查询不同保真度的训练样本,自动确定数据集组成,在降低数据生成成本的同时提高模型精度。

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Comments
Supplementary Information added as separate PDF
AI中文摘要

机器学习加速了量子化学,但受到生成高保真训练数据的高昂成本的阻碍。多保真机器学习(MFML)通过系统性地结合丰富的低保真数据和稀疏的高保真数据来减轻这一开销。尽管取得了成功,标准MFML方案依赖于预定义的缩放因子来确定不同保真度之间的稀疏数据比例,通常会产生冗余的多保真数据,导致效率损失。在这里,我们介绍了一种用于机器学习的自适应即时多保真框架,该框架自主确定训练数据集的组成。通过动态查询每个保真度的训练样本,该算法在转向更昂贵的参考计算之前,先在较低保真度上使模型精度饱和。我们在不同的化学性质上对新颖的自适应MFML进行了基准测试,包括计算化学金标准的耦合簇能量,以及更具化学挑战性的激发能。在我们的数值实验中,我们表明,与单保真方法相比,我们的自适应算法将数据生成成本降低了多达30倍,并且与标准MFML相比提高了多达5倍。数据冗余的缓解为量子化学中可持续的成本感知机器学习建立了一条高精度、低成本的途径。

英文摘要

Machine learning has accelerated quantum chemistry but is hindered by the prohibitive cost of generating high fidelity training data. Multifidelity machine learning (MFML) mitigates this overhead by systematically combining abundant low fidelity data with sparse high fidelity data. In spite of its success, standard MFML schemes rely on pre-defined scaling factors to determine sparse data ratio across fidelities, often generating redundant multifidelity data resulting in a loss of efficiency. Here, we introduce an adaptive on-the-fly multifidelity framework for machine learning that autonomously determines training dataset composition. By dynamically querying training samples at each fidelity, the algorithm saturates model accuracy at lower fidelities before moving up to more expensive reference calculations. We benchmark the novel adaptive-MFML across diverse chemical properties including the computational chemistry gold standard coupled cluster energies, and the more chemically challenging excitation energies. In our numerical experiments we show that our adaptive algorithm reduces data generation costs by up to a factor of 30 compared to single fidelity methods and improves upon standard MFML by up to a factor of 5. The mitigation of data redundancy establishes a high-accuracy low-cost pathway for sustainable cost-aware machine learning in quantum chemistry.

2606.02627 2026-06-03 cs.CE cs.DC cs.GR physics.flu-dyn

Streami: An MPI Data-Parallel Library to Compute Field Lines on GPUs

Streami: 一个用于在GPU上计算场线的MPI数据并行库

Stefan Zellmann, Milan Jaros, Andrea Paris, Ingo Wald, Tatiana von Landesberger

AI总结 提出Streami,一个可扩展的GPU加速库,用于在高性能计算机上计算流体流场中的场线,支持后处理或原位分析,并与现有MPI应用交互。

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AI中文摘要

我们提出了Streami,一个可扩展的GPU加速库,用于在高性能计算机上计算流体流场中的场线。Streami作为一个薄层,可用于事后或原位分析,并能与现有的MPI应用程序交互。我们讨论了Streami的应用程序编程接口、导致Streami高性能和可扩展性的关键设计决策,以及支持不同流体流场表示的扩展。我们还提供了一个用于快速原型设计和交互式种子点放置的示例应用程序。Streami在宽松的开源软件许可下发布。

英文摘要

We present Streami, an extensible GPU-accelerated library for the computation of field lines in fluid flows on high-performance computers. Streami acts as a thin layer used for both post-hoc or in-situ analysis and can interface with existing MPI applications. We discuss Streami's application programming interface, key design decisions that led to Streami's high performance and extensibility, as well as extensions to support different fluid flow field representations. We also present a sample application for rapid prototyping and interactive seed point placement. Streami is released under a permissive open-source software license.

2606.02618 2026-06-03 cs.CE cs.AI cs.MA physics.chem-ph

Closed-Loop Molecular Design with Calibrated Deference

闭环分子设计中的校准式退让

Newman Cheng, Gordon Broadbent, Jason Dong, Syed Mohammed Ali Hussaini, Farman Ullah, Morris Sharp, Gabrielle Barnes, Nanlin Guo, Deyu Zou, Karin Strauss, William Chappell, David G. Kwabi, Bichlien H. Nguyen, Jake A. Smith

AI总结 提出CLIO智能体,通过持续更新的信念状态图和递归计划-行动循环实现校准式退让,在闭环人机协作中成功设计出性能优于文献基准的AORFB负极电解液。

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AI中文摘要

我们提出了通过原位优化实现认知循环(CLIO),这是一种将持续更新的信念状态图与递归计划-行动循环相结合的智能体。结果产生了一个推理智能体,能够贡献某种定性的不同之处,我们称之为“校准式退让”:即识别自身工具或假设何时失败、相应调整策略、并生成指导实验修订的机制性假设的能力。我们在一个闭环人机协作活动中测试了CLIO,以设计一种水性有机氧化还原液流电池(AORFB)负极电解液,CLIO在与合成、表征并参与设计选择的化学家密切合作中主导了提议和解释。在三轮共17个候选分子中,CLIO收敛于一个最佳的膦酸酯候选物;表征证实其氧化还原电位比文献基准提高了130 mV。随后表征揭示了出乎意料的差电化学可逆性——这是所有性质预测器都未能标记的回归。CLIO生成了相互竞争的机制性假设,优先安排了诊断性实验,将失败归因于膦酸酯-钾离子配对,并建议用磺酸酯替代。所得化合物显示出显著改善的电化学可逆性,并保持了90 mV的氧化还原电位提升,从而闭环了设计-制造-测试-再设计循环。

英文摘要

We present Cognitive Loop via In-Situ Optimization (CLIO), an agent that couples a continuously-updated belief-state graph with a recursive plan-then-act loop. The result is a reasoning agent that can contribute something qualitatively different, which we term \emph{calibrated deference}: the capacity to recognize when its own tools or assumptions are failing, to adapt its strategy in response, and to generate mechanistic hypotheses that guide experimental revision. We tested CLIO in a closed-loop human-AI campaign to design an aqueous organic redox flow battery (AORFB) negolyte, with CLIO leading proposal and interpretation in close partnership with chemists who synthesized, characterized, and weighed in on design choices. Across 17 candidates over three rounds, CLIO converged on a top phosphonate candidate; characterization confirmed a 130~mV improvement in redox potential over the literature baseline. Characterization then revealed unexpectedly poor electrochemical reversibility -- a regression no property predictor had flagged. CLIO generated competing mechanistic hypotheses, prioritized discriminating diagnostics, traced the failure to phosphonate-potassium ion pairing, and prescribed a sulfonate replacement. The resulting compound showed substantially improved electrochemical reversibility and maintained a 90~mV improvement in redox potential, closing the design-make-test-redesign loop.

2606.02610 2026-06-03 cs.CE cs.AI cs.LG physics.ao-ph

Samudra 2: Scaling Ocean Emulators across Resolutions

Samudra 2: 跨分辨率扩展海洋仿真器

Yuan Yuan, Jesse Rusak, Alexander Merose, Adam Subel, Pavel Perezhogin, Alistair Adcroft, Carlos Fernandez-Granda, Laure Zanna

AI总结 针对现有海洋神经仿真器在长期自回归滚动中出现的方差崩溃和印记伪影问题,提出Samudra 2,通过改进U-Net骨干网络和动态损失函数,在1°分辨率下将上层海洋全球平均温度R²从0.56提升至0.87,并将深层海洋温度误差降低约七倍,且可扩展至1/2°和1/4°分辨率。

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AI中文摘要

海洋环流模式(OGCM)对气候科学至关重要,但计算成本高,限制了集合规模和强迫情景。神经仿真器有望实现数量级的加速,然而现有的海洋仿真器未能将精细空间分辨率与多年自回归滚动相结合。Samudra是第一个产生多十年全球滚动的自回归神经海洋仿真器,但仅限于$1^\\\circ$分辨率,并表现出两种长期故障模式:\\emph{方差崩溃},即时间变异性的丧失,以及\\emph{印记伪影},即速度模式泄漏到深海场中。我们提出Samudra 2,它引入了更宽的U-Net骨干网络,采用修改后的ConvNeXt风格块和减小的块内扩展因子,以及一个动态损失函数,根据预测误差重新加权输出通道,从而增强缓慢演变的深海场的梯度。在$1^\\\circ$分辨率下,Samudra 2将上层海洋全球平均温度$R^2$从0.56提高到0.87,并将深海温度误差降低约七倍。相同的架构可扩展到$1/2^\\\circ$和$1/4^\\\circ$分辨率,在大约8年的自回归滚动中恢复中尺度涡旋和尖锐的西边界流。在单个GPU上运行,Samudra 2能够为海平面预测、海洋热吸收和气候变率研究提供更大的集合。我们在此https URL提供代码、文档和基准资源。

英文摘要

Ocean general circulation models (OGCMs) are essential to climate science but computationally expensive, limiting ensemble size and forcing scenarios. Neural emulators promise orders-of-magnitude speedups, yet existing ocean emulators have not combined fine spatial resolution with multi-year autoregressive rollouts. Samudra, the first autoregressive neural ocean emulator to produce multi-decade global rollouts, is limited to $1^\circ$ resolution and exhibits two long-horizon failure modes: \emph{variance collapse}, the loss of temporal variability, and \emph{imprinting artifacts}, in which velocity patterns leak into deep-ocean fields. We present Samudra 2, which introduces a wider U-Net backbone with modified ConvNeXt-style blocks and a reduced block-internal expansion factor, together with a dynamic loss that reweights output channels according to their prediction errors, strengthening gradients for slow-evolving deep-ocean fields. At $1^\circ$, Samudra 2 increases upper-ocean global-mean temperature $R^2$ from 0.56 to 0.87 and reduces deep-ocean temperature error by roughly sevenfold. The same architecture scales to $1/2^\circ$ and $1/4^\circ$ over approximately 8-year autoregressive rollouts, recovering mesoscale eddies and sharp western boundary currents. Running on a single GPU, Samudra 2 enables larger ensembles for sea-level projections, ocean heat uptake, and climate variability studies. We provide code, documentation, and benchmark resources at https://openathena.ai/Ocean_Emulator/.

2606.03621 2026-06-03 math.FA math-ph math.MP math.OA math.QA

The Time-Frequency Covariance Principle on Unimodular Kac Algebras

幺模Kac代数上的时频协方差原理

Xiao Chen, Rui Liu, Yuxuan Zheng

AI总结 本文将短时傅里叶变换推广到幺模Kac代数量子群框架,引入时频平移算子,建立其分析性质、投影余表示结构,并推导协方差原理和不确定性原理。

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AI中文摘要

本文将短时傅里叶变换(STFT),即时频分析中的基本工具,推广到幺模Kac代数的量子群框架。对于幺模Kac代数 \mathbb{G},我们引入一个结合左平移和调制算子的时频平移算子。使用 Hilbert 空间 L^2(\mathbb{G}) 中的窗口向量,我们定义相应的 STFT 并建立其基本分析性质,包括 Plancherel 定理、Moyal 恒等式、反演公式和基本恒等式。此外,我们探讨时频平移算子的投影余表示结构,并证明其反射版本诱导了量子对偶的对偶量子群的连续投影左表示。最后,我们推导出协方差原理和若干不确定性原理。

英文摘要

This paper extends the short-time Fourier transform (STFT), a fundamental tool in time-frequency analysis, to the quantum group setting of unimodular Kac algebras. For a unimodular Kac algebra \mathbb{G}, we introduce a time-frequency shift operator that combines left translation and modulation operators. Using a window vector in the Hilbert space L^2(\mathbb{G}), we define the corresponding STFT and establish its essential analytic properties, including a Plancherel theorem, the Moyal identity, an inversion formula, and a fundamental identity. Furthermore, we explore the projective corepresentation structure of the time-frequency shift operator, and prove that its reflected version induces a continuous projective left representation of the dual quantum group of the quantum double. Finally, we derive the covariance principle and several uncertainty principles.

2606.03079 2026-06-03 math.PR math-ph math.MP

Mean Field Limits for Stochastic, Underdamped Reactive Langevin Dynamics Models

随机欠阻尼反应朗之万动力学模型的平均场极限

Samuel A Isaacson, Qianhan Liu, Konstantinos Spiliopoulos

AI总结 本文严格推导了基于粒子的反应朗之万动力学模型在大种群下的有效平均场动力学,证明了位置-速度相空间上的测度值随机过程收敛到确定性平均场极限,得到了一类新的非局部动力学反应扩散偏积分微分方程组。

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Comments
arXiv admin note: text overlap with arXiv:2309.03431
AI中文摘要

我们严格推导了基于粒子的反应朗之万动力学(PBRLD)模型的有效大种群平均场动力学。这些模型通过引入速度、惯性效应和欠阻尼运动,扩展了基于粒子的随机反应扩散(PBSRD)描述。在Isaacson, Liu, Spiliopoulos, and Yao, SIAP 2026中,PBRLD模型被提出,并证明在过阻尼极限下恢复Doi体积反应性PBSRD模型。在这项工作中,我们证明了表示位置-速度相空间上物种浓度场的相关测度值随机过程收敛到确定性平均场极限。极限方程形成了一类新的非局部动力学反应扩散偏积分微分方程组,将亚椭圆输运与保留底层粒子相互作用的空间和速度结构的反应项耦合起来。

英文摘要

We rigorously derive the effective large-population, mean-field dynamics of particle-based reactive Langevin dynamics (PBRLD) models. These models extend particle-based stochastic reaction-diffusion (PBSRD) descriptions by incorporating velocities, inertial effects, and underdamped motion. In Isaacson, Liu, Spiliopoulos, and Yao, SIAP 2026, PBRLD models were formulated and shown to recover Doi volume reactivity PBSRD model in the overdamped limit. In this work we prove convergence of the associated measure-valued stochastic processes, representing species concentration fields on position-velocity phase space, to a deterministic mean-field limit. The limiting equations form a novel system of nonlocal kinetic reaction-diffusion partial integro-differential equations, coupling hypoelliptic transport with reaction terms that retain the spatial and velocity structure of the underlying particle interactions.

2606.02989 2026-06-03 math.AP nlin.SI

The Benjamin-Ono Equation in the Long-Time Limit: Linearized Self-Similar Universality

Benjamin-Ono 方程在长时间极限下的线性化自相似普适性

Louise Gassot, Patrick Gérard, Peter D. Miller

AI总结 研究 Benjamin-Ono 方程在 $t\to+\infty$ 且 $x=O(t^{1/2})$ 极限下的解的前导项,证明衰减率超过自相似解,并得到显式普适衰减轮廓,关联到自相似解轮廓方程的线性化。

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33 pages, 6 figures. Comments welcome
AI中文摘要

我们得到了 Benjamin-Ono 方程在极限 $t\to+\infty$ 且 $x=O(t^{1/2})$ 下 Cauchy 问题的解的前导项。我们证明衰减率超过自相似解,并得到了衰减解的显式普适轮廓,将其与自相似解的轮廓方程的线性化联系起来。该证明假设一类有理初始数据 $u_0$ 属于 $L^2(\mathbb{R})\cap L^1(\mathbb{R})$,且反射系数在原点处具有一般行为。

英文摘要

We obtain the leading term in the solution of the Cauchy problem for the Benjamin-Ono equation in the limit $t\to+\infty$ with $x=O(t^{1/2})$. We show that the rate of decay exceeds that of self-similar solutions and obtain an explicit universal profile for the decaying solution, relating it to the linearization of the profile equation for self-similar solutions. The proof assumes a class of rational initial data $u_0$ in $L^2(\mathbb{R})\cap L^1(\mathbb{R})$ that exhibit generic behavior of the reflection coefficient at the origin.

2606.02903 2026-06-03 math.AG math-ph math.MP

Cohomology of complex supertori

复超环面的上同调

Hargun Bhatia, Soumya Ganguly, Zhiyuan Jiang, Jeffrey M Rabin, Steven V Sam

AI总结 研究由代数无关奇参数平移得到的超环面,通过李代数上同调确定其结构层的凝聚上同调群,并计算Picard群。

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33 pages
AI中文摘要

我们考虑超环面,它是仿射超空间通过代数无关奇参数平移得到的商。具体地,我们通过生成元和关系描述了其全局截面空间的环结构,并通过将其简化为李代数上同调问题,完全确定了其结构层的凝聚上同调群。我们还证明了层上同调中的庞加莱对偶性与平移群的群上同调中的庞加莱对偶性兼容,并给出了显式的例子表格。最后,我们计算了这些超环面的Picard群。

英文摘要

We consider supertori which are quotients of affine superspace by translations by algebraically independent odd parameters. Specifically, we describe the ring structure of its space of global sections by generators and relations and completely determine the coherent cohomology groups of its structure sheaf by reducing it to a problem of Lie algebra cohomology. We also show that Poincaré duality on sheaf cohomology is compatible with that of the group cohomology of the translation group and give explicit tables of examples. Finally, we compute the Picard groups of these supertori.

2606.03964 2026-06-03 quant-ph

Informational completeness of qubit measurements and IC preservability of qubit channels: Characterization and Quantification

量子比特测量的信息完备性及量子比特通道的IC可保持性:刻画与量化

Jatin Ghai, Arindam Mitra

AI总结 本文引入并刻画了任意量子测量信息完备性的忠实度量,评估了量子比特SIC测量的信息完备性,并建立了量子通道信息完备性可保持性的度量及其与绝对输出相干性的关系。

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AI中文摘要

信息完备(IC)测量是一类有用的测量,因为它们的输出统计唯一地确定一个未知量子态。因此,它们对于某些任务(如量子态层析、量子过程层析等)很重要。在这项工作中,我们通过引入并刻画一个忠实度量来研究任意量子测量的信息完备性的量化。我们明确评估了量子比特对称信息完备(SIC)测量的信息完备性,并表明它是所有量子比特最小信息完备测量的上界。此外,通过引入一个忠实度量,我们试图量化和刻画任意量子通道在Heisenberg图像中作用于任何IC测量时保持其信息完备性的能力。我们将这个度量称为量子通道的信息完备性可保持性(IC可保持性)。在研究了其性质之后,我们最终建立了它与另一个量——即量子通道的绝对输出相干性——的关系,该量量化了从该通道输出中总能获得的最小相干性(相对于任意非相干基)。因此,在这项工作中,我们不仅试图为研究量子测量的信息完备性和量子通道保持它的能力提供一个定量框架,而且还试图提供关于信息完备性与量子相干性之间概念关系的关键见解。

英文摘要

Informationally complete (IC) measurements are a useful class of measurements, as their outcome statistics uniquely determine an unknown quantum state. Hence, they are important for certain tasks such as quantum state tomography, quantum process tomography, etc. In this work, we study the quantification of informational completeness for arbitrary quantum measurements by introducing and characterizing a faithful measure for it. We explicitly evaluate the informational completeness of qubit symmetric informationally complete (SIC) measurements and show that it is an upper bound for all qubit minimal informationally complete measurements. Furthermore, by introducing a faithful measure, we try to quantify and characterize the ability of an arbitrary quantum channel to preserve informational completeness of any IC measurement when the channel acts on it in the Heisenberg picture. We call this measure informational completeness-preservability (IC preservability) of quantum channels. After studying its properties, we finally establish its relation to another quantity, namely, the absolute output coherence of a quantum channel, which quantifies the minimum amount of coherence (w.r.t. an arbitrary incoherent basis) that can always be obtained from the output of that channel. Thus, in this work, not only do we try to provide a quantitative framework for studying both the informational completeness of quantum measurements and the ability of quantum channels to preserve it, but we also try to offer key insight into the conceptual relation between informational completeness and quantum coherence.

2606.03956 2026-06-03 quant-ph cond-mat.stat-mech

Operator spreading in random circuits with orthogonal or symplectic symmetry

正交或辛对称随机电路中的算子扩散

Zhiyang Tan, Piet W. Brouwer

AI总结 研究从正交不变或辛不变系综中抽取门组成的随机量子电路中的算子扩散,揭示了与酉不变情况的关键区别,包括权重三元结构、有限宽度畴壁以及蝴蝶速度的二分性。

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33 pages, 8 figures
AI中文摘要

我们研究了从正交不变或辛不变系综中抽取门组成的随机量子电路中的算子扩散,揭示了与已充分研究的酉不变情况的一些关键区别。我们发现,系综平均的泡利串权重弛豫到三元值结构,而不是酉不变电路中的二元结构。对于正交或辛不变电路,分隔平凡区域和混乱区域的畴壁具有有限宽度,即使对于Haar随机门也是如此,而Haar分布随机酉电路的畴壁是尖锐的。我们进一步发现,来自正交群两个不连通分量的两量子比特门随机电路之间存在根本性二分:虽然特殊正交系综的蝴蝶速度介于零和Haar值之间,但负行列式扇区对于任何门分布都存在非零下界。此外,对于qudit大小$q=2$,蝴蝶速度可以超过Haar随机系综的速度。

英文摘要

We investigate operator spreading in random quantum circuits with gates drawn from orthogonal-invariant or symplectic-invariant ensembles, revealing several key distinctions from the well-studied unitary-invariant case. We find that the ensemble-averaged Pauli-string weights relax to a ternary-valued structure, instead of the binary structure of unitary-invariant circuits. For orthogonal- or symplectic-invariant circuits, the domain wall separating trivial and scrambled regions has a finite width even for Haar-random gates, whereas domain walls are sharp for Haar-distributed random unitary circuits. We further find a fundamental dichotomy between random circuits with two-qubit gates from the two disconnected components of the orthogonal group: While the butterfly velocity for the special orthogonal ensemble lies between zero and the Haar value, the negative-determinant sector exhibits a non-zero lower bound for any gate distribution. Moreover, for qudit size $q=2$, the butterfly velocity can exceed that of the Haar-random ensemble.

2606.03916 2026-06-03 quant-ph cond-mat.other

Practical gates by Majorana fermion motion

马约拉纳费米子运动的实用门

Yuri D. Lensky, Bryce Kobrin, Kostyantyn Kechedzhi, Igor Aleiner

AI总结 本文通过马约拉纳费米子运动实现容错逻辑门,提出紧凑运动原语以降低空间开销,数值表明在近期错误率下优于晶格手术。

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AI中文摘要

量子纠错协议通过非局域存储逻辑信息来抵御局部错误。这带来了一个挑战:如何设计作用于非局域“隐藏”逻辑信息的高效逻辑门,以及如何利用局域物理操作实现这些门。我们发展了平面泡利稳定子码和逻辑操作的一般描述,以称为马约拉纳费米子的点状粒子为基础。信息存储在空间分离的马约拉纳费米子的成对费米子奇偶性中。基于马约拉纳费米子的描述不仅捕捉了大距离渐近行为,还涵盖了直至晶格常数的所有尺度。我们利用这种局域性在时空中密集打包逻辑信息。最简单的应用是静态情况:密集存储器。更重要的是,我们实现了容错马约拉纳运动,并利用这一原语设计基于编织的逻辑门。这种方法降低了逻辑操作的空间开销,从而在固定物理量子比特数下改善了逻辑错误率。我们通过设计和基准测试2量子比特克利福德门,说明了我们方法的实际用途。数值结果表明,在近期错误率和实际设备约束下,我们的协议在此设置中优于晶格手术。更一般地,引入马约拉纳费米子的紧凑运动作为高效计算原语,为设计低开销纠错协议开辟了一条有前景的新途径。

英文摘要

Quantum error correction protocols protect against local errors by storing logical information non-locally. This poses a challenge: how to design efficient logical gates on the non-local ``hidden'' logical information, and how to implement these gates using the local physical operations. We develop a general description of planar Pauli stabilizer codes and protocols for logical operations in terms of point-like particles called Majorana fermions. Information is stored in the pairwise fermion parities of spatially separated Majorana fermions. The description in terms of Majorana fermions captures not only large distance asymptotics, but also all scales down to the lattice constants. We exploit this locality to densely pack logical information in spacetime. The simplest application is to a static case: dense memory. More importantly, we implement fault-tolerant Majorana motion and leverage this primitive to design braiding-based logical gates. This approach reduces space overhead of logical operations resulting in an improved logical error rate given fixed number of physical qubits. We illustrate a practical use of our approach by designing and benchmarking of 2-qubit Clifford gates. We find numerically that our protocol outperforms lattice surgery in this setting for near-term error rates and realistic device constraints. More generally, introduction of compact motion of Majorana fermions as an efficient computational primitive opens a promising new route for the design of low overhead error correction protocols.

2606.03914 2026-06-03 quant-ph physics.optics

Quantum Erasure Imaging: Complementary Modalities from Delayed-Choice Erasure

量子擦除成像:来自延迟选择擦除的互补模态

Sean D Huver, Sanjaya Lohani

AI总结 提出量子擦除成像协议,通过延迟选择擦除和远程辅助比特的回顾性分类,从单次时间标记符合测量中同时重建吸收和相位敏感余弦正交两种模态,并推导了平衡双端口估计器和Fisher信息,证明了与标记随机化时间划分的等价性。

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6 pages, 4 figures, 1 table
AI中文摘要

量子擦除成像(QEI)将延迟选择擦除转化为一种实用的成像协议。纠缠光子对编码两种经典模态:吸收 $T(x,y)$ 和 $\phi(x,y)$ 的相位敏感余弦正交,通过远程辅助比特上的回顾性分类,从单次时间标记符合测量中重建。在 H/V 基下测量辅助比特通过路径信息得到 $T$;在 D/A 基下得到干涉可见度 $\propto rac{2\sqrt{T}}{T+1}\cos\phi$;旋转的正交分析器可在两者之间连续切换。我们推导了平衡双端口估计器,其分母与分析器无关(完备性/无信号),以及 Fisher 信息(FI)和 Cramér--Rao 界(CRBs),建立了与标记随机化时间划分的等价性。QEI 的优势在于操作层面:单次采集、完美配准以及远程/延迟模式选择。我们通过蒙特卡洛模拟展示了该协议,并开源了代码。

英文摘要

Quantum Erasure Imaging (QEI) turns delayed-choice erasure into a practical imaging protocol. Entangled photon pairs encode two classical modalities, absorption $T(x,y)$ and a phase-sensitive cosine quadrature of $ϕ(x,y)$, reconstructed from a single run of time-tagged coincidences by retrospective sorting on a remote ancilla. Measuring the ancilla in H/V yields $T$ via which-path information; D/A yields interference visibility $\propto \frac{2\sqrt{T}}{T+1}\cosϕ$; and a rotated orthonormal analyzer continuously trades between them. We derive balanced two-port estimators whose denominators are analyzer independent (completeness / no signaling), together with Fisher information (FI) and Cramér--Rao bounds (CRBs) that establish an equivalence to time division under labeled randomization. The advantages of QEI are operational: single-run acquisition, perfect co-registration, and remote / delayed mode choice. We illustrate the protocol with Monte-Carlo simulations and open source our code.

2606.03898 2026-06-03 quant-ph

Squeezed-state semi-device-independent quantum randomness generation

压缩态半设备无关量子随机数生成

Hamid Tebyanian

AI总结 研究使用可信二元纯态源和具有经典边信息的不信任二元探测器的半设备无关量子随机数生成,推导出闭式香农率表达式,并发现包含确定性极值点可显著降低认证率,最后应用于压缩相干BPSK源。

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11 pages, 6 figures
AI中文摘要

本文研究了具有可信二元纯态源和不信任二元探测器的半设备无关量子随机数生成,其中探测器的边信息是经典的。我们推导出该设置的闭式香农率表达式,该表达式仅依赖于两个源状态的可信Gram重叠和观测到的对称错误概率。关键点在于,完整的二元量子比特POVM优化必须包括投影处理所忽略的两个确定性极值点;包含它们会得到显著更低且正确的认证率。闭式表达式是认证渐近独立同分布香农率的无条件上界,并在数值验证的对偶可行区域(包含本文使用的所有操作点)上成为紧界。在该区域外,同一表达式仍保持为上界。然后,我们将结果应用于压缩相干BPSK源,展示了在无损耗和有损耗情况下压缩如何改变状态可区分性与认证随机性之间的权衡。最后,我们阐明了当对手被允许持有标记结果的探测器纯化寄存器时的对手模型。

英文摘要

This paper investigates semi-device-independent quantum randomness generation with a trusted binary pure-state source and an untrusted binary detector whose side information is classical. We derive a closed-form Shannon-rate expression for this setting, depending only on the trusted Gram overlap of the two source states and the observed symmetric error probability. The key point is that the full binary-qubit POVM optimisation must include the two deterministic extreme points omitted by the projective-only treatment; including them gives a substantially lower, and correct, certified rate. The closed form is an unconditional upper bound on the certified asymptotic i.i.d.\ Shannon rate, and becomes tight on a numerically verified dual-feasibility region containing all operating points used in the paper. Outside this region the same expression remains an upper bound. We then apply the result to squeezed-coherent BPSK sources, showing how squeezing changes the trade-off between state distinguishability and certified randomness in the lossless and lossy regimes. Finally, we clarify the adversary model if the adversary is allowed to hold a detector-purification register that tags the outcome.