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科学与医疗

AI for Science

科学智能、蛋白质、分子、药物、材料、气象、物理和数学 AI。

今日/当前日期收录 168 信号源:cs.LG, q-bio, physics, cond-mat, math, stat.ML

1. 物理仿真 24 篇

2504.15501 2026-06-19 quant-ph cond-mat.mes-hall physics.chem-ph physics.optics 版本更新 80%

Mapping molecular polariton transport via pump-probe microscopy

通过泵-探测显微镜映射分子极子输运

Piper Fowler-Wright, Michael Reitz, Joel Yuen-Zhou

专题命中 物理仿真 :分子极子输运泵-探测显微镜研究

AI总结 本文通过泵-探测显微镜研究分子极子输运特性,结合微正则处理和扰动展开,揭示了极子输运与分子退相干和暗激发态人口的关系。

Comments 7+12 pages, 4+9 figures. Includes supplementary movie file showing pump-probe dynamics. [v3] close to published version, [v4] fixed wrong SI title

Journal ref Nano Lett. 2026, 26, 19, 6334-6340

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AI中文摘要

我们展示了如何通过泵-探测光谱的微观建模来提取光学腔中分子极子输运性质。我们的方法结合了光-物质哈密顿量的平均场处理,以及光和物质组分的微扰展开,以及空间粗粒化。该方法将 semiclassical 镜厅光谱学扩展到多模光-物质相互作用,提供了空间分辨的瞬态光谱的完整访问。通过模拟具有反向传播泵和探测脉冲的显微镜实验,我们计算了差分传输,并展示了分子退相干和持久暗激发子人口如何驱动根均方位移的亚子组速度输运。我们分析了极子色散跨运输,显示速度重整化与激发子权重的相关性,与实验观测一致,并进一步揭示其依赖于分子退相干速率。我们的结果强调了在极子系统中表征输运时考虑测量光谱观测变量的必要性。

英文摘要

We demonstrate how the transport properties of molecular polaritons in optical cavities can be extracted from a microscopic modeling of pump-probe spectroscopy. Our approach combines a mean-field treatment of the light-matter Hamiltonian with a perturbative expansion of both light and matter components, along with spatial coarse-graining. This approach extends semiclassical cavity spectroscopy to multimode light-matter interactions, providing full access to spatially resolved transient spectra. By simulating a microscopy experiment with counter-propagating pump and probe pulses, we compute the differential transmission and show how molecular dephasing and persistent dark exciton populations drive sub-group-velocity transport of the root-mean-square displacement. We analyze transport across the polariton dispersion, showing how velocity renormalization correlates with excitonic weight, consistent with experimental observations, and further its dependence on the rate of molecular dephasing. Our results highlight the need to consider measured spectroscopic observables when characterizing transport in polaritonic systems.

2604.08193 2026-06-19 hep-ph astro-ph.CO astro-ph.IM physics.ins-det physics.optics 版本更新 80%

Probing Majoron Dark Matter with Gravitational Wave Detectors

利用引力波探测器探测马约拉子暗物质

Ippei Obata, Tsutomu T. Yanagida

专题命中 物理仿真 :引力波探测器探测马约拉子暗物质

AI总结 研究通过线性光学腔探测马约拉子暗物质与光子的QED反常耦合导致的振荡双折射,利用地面激光干涉仪如Advanced LIGO、KAGRA等探测参数空间。

Comments 10 pages, 3 figures

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AI中文摘要

马约拉子是一种假设的(赝)南部-戈德斯通玻色子,源于全局轻子数对称性的自发破缺,被认为是宇宙中暗物质的候选者。在本文中,我们研究了利用干涉式引力波探测器中使用的线性光学腔探测马约拉子暗物质的可能性。我们考虑一种场景,其中马约拉子暗物质通过QED反常与光子耦合,导致由相干暗物质背景诱导的振荡光子双折射。反常系数通过要求模型同时再现电弱希格斯尺度和典型的右手中微子质量尺度来确定,由此产生的暗物质-光子耦合自然落在光学干涉仪的灵敏度范围内。通过加入额外的光学元件来提取双折射信号,我们发现地面激光干涉仪如Advanced LIGO、KAGRA以及未来的探测器,可以探测马约拉子暗物质的参数空间区域。

英文摘要

The Majoron is a hypothetical (pseudo) Nambu-Goldstone boson arising from the spontaneous breaking of a global lepton number symmetry, and is known as a candidate for dark matter in our Universe. In this paper, we investigate the possibility of probing the Majoron dark matter with a linear optical cavity used in the interferometric gravitational wave detectors. We consider a scenario in which the Majoron dark matter couples to photons through a QED anomaly, leading to an oscillatory photon birefringence induced by the coherent dark matter background. The anomaly coefficient is fixed by requiring the model to simultaneously reproduce the electroweak Higgs scale and a typical right-handed Majorana neutrino mass scale, and the resulting dark matter-photon coupling naturally falls within the sensitivity range of optical interferometers. By incorporating additional optics to extract the birefringence signal, we find that ground-based laser interferometers such as Advanced LIGO, KAGRA, as well as future detectors, can probe a region of the parameter space of Majoron dark matter.

2603.25949 2026-06-19 physics.plasm-ph astro-ph.HE 版本更新 80%

General-relativistic and non-ideal radiative cooling in neutron star magnetospheres

中子星磁层中的广义相对论与非理想辐射冷却

João Joaquim, Francisco Assunção, Pablo J. Bilbao, Luis O. Silva

专题命中 物理仿真 :研究中子星磁层辐射冷却,天体物理

AI总结 研究辐射反冲冷却在中子星磁层中的效应,发现非均匀电磁场和广义相对论增强相空间动力学不稳定性,有利于相干辐射发射。

Comments 12 pages, 5 figures

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AI中文摘要

辐射反冲冷却在描述天体物理致密天体磁层中的极端等离子体条件中起着重要作用。这些环境特有的强电磁场可以触发各向异性环状等离子体分布的发展,在动量空间中具有反转的朗道分布。在这项工作中,我们通过考虑非均匀电磁场几何和广义相对论效应如何修改辐射冷却等离子体的相空间动力学,首次系统地研究了这种机制在实际天体物理配置中的表现。我们解析地证明,漂移速度有利于形成仍然显示反转朗道分布的螺旋形动量分布,并估计了反转动量分布通过动力学不稳定性驱动相干辐射发射所需的最小和最大等离子体注入距离。通过数值模拟,我们得出结论:弯曲时空增加了负责动力学不稳定性发展的分布函数的梯度,并相对于平直时空延长了反转动量结构的持久性,证实了实际天体物理条件保留并增强了同步辐射驱动的相干辐射发射所需的条件。

英文摘要

Radiation reaction cooling plays an important role in describing the extreme plasma conditions found in the magnetospheres of astrophysical compact objects. Strong electromagnetic fields, characteristic of these environments, can trigger the development of anisotropic ring-shaped plasma distributions with inverted Landau populations in momentum space. In this work, we present the first systematic investigation of this mechanism in realistic astrophysical configurations, by accounting for how non-uniform electromagnetic field geometries and general-relativistic effects modify the phase-space dynamics of radiatively cooled plasmas. We demonstrate analytically that drift velocities favour the formation of spiral-shaped momentum distributions that still display inverted Landau populations, and estimate the minimum and maximum plasma injection distances required for inverted momentum distributions to be able to power the emission of coherent radiation through kinetic instabilities. From numerical simulations, we conclude that curved spacetime increases the gradient of the distribution function responsible for the development of kinetic instabilities, and prolongs the persistence of the inverted momentum structure relative to flat spacetime, confirming that realistic astrophysical conditions preserve and enhance the conditions necessary for synchrotron-powered emission of coherent radiation to occur.

2603.23021 2026-06-19 cond-mat.stat-mech 版本更新 80%

Dynamics of Aligning Active Matter: Mapping to a Schrödinger Equation and Exact Diagonalization

对齐活性物质的动力学:映射到薛定谔方程与精确对角化

Tara Steinhöfel, Horst-Holger Boltz, Thomas Ihle

专题命中 物理仿真 :活性物质动力学映射到薛定谔方程

AI总结 通过将Fokker-Planck方程映射到薛定谔方程并进行精确对角化,严格分析了小尺度全连接对齐自推进粒子的弛豫模式,改进了线性化统计场论的近似结果,并扩展到非互易相互作用情形。

Journal ref Eur. Phys. J. Spec. Top.(2026)

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AI中文摘要

最近,小尺度全连接对齐自推进粒子系统的弛豫模式引起了关注(Spera等人,Phys. Rev. Lett. {\bf 132}: 078301 (2024))。我们重新审视Fokker-Planck方程与薛定谔方程之间的经典联系,通过精确对角化来处理这一问题,从而对全谱进行严格的分析洞察。这使我们能够提取精确结果,并与线性化统计场论的现有结果进行比较。我们推导出渐近正确的解析结果,改进了先前的近似。我们表明,该方法可以有效地扩展到非互易相互作用的情形,这导致了类似于开放量子力学中的非厄米薛定谔问题。虽然非互易性可以选择为不改变稳态分布,但它从根本上改变了稳态的性质,我们通过熵产生来量化这一点。我们讨论了低粒子数的情况以及大粒子数时平均场动力学的出现。

英文摘要

There has been recent interest in the relaxational modes of small-scale fully connected systems of aligning self-propelled particles (Spera et al., Phys. Rev. Lett. {\bf 132}: 078301 (2024)). We revisit the classical connection between Fokker-Planck and Schrödinger equations to address this by means of exact diagonalization, allowing for rigorous analytical insight into the full spectrum. This allows us to extract exact results which we compare to the existing result from linearized statistical field theory. We derive asymptotically correct analytical results that improve upon the prior approximations. We show that this methodology can fruitfully be extended to the case of non-reciprocal interactions which gives rise to a non-Hermitian Schrödinger problem akin to those in open quantum mechanics. While the non-reciprocity can be chosen such as not to alter the stationary distribution, it fundamentally changes the nature of the steady state which we quantify via the entropy production. We discuss the case of low particle numbers as well as the emergence of mean-field dynamics at large numbers.

2603.04143 2026-06-19 cond-mat.mes-hall 版本更新 80%

Constructing Exceptional Knots and Links with Arbitrary Braiding Topology

构造具有任意编织拓扑的例外纽结与链环

Bin Jiang, Aolong Guo, Qilin Cai, Jian-Hua Jiang

专题命中 物理仿真 :构造非厄米系统中例外纽结,凝聚态物理。

AI总结 提出基于辫理论与半全纯多项式的通用框架,在三维两带非厄米系统中实现任意编织拓扑的例外纽结与链环,并展示可控拓扑转变。

Comments Commemts are welcome

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AI中文摘要

例外纽结和链环代表了一类显著的非厄米金属,其中例外简并在动量空间中形成纽结或链环流形。在此,我们报告了一个通用构造框架,用于在三维最小两带非厄米系统中实现具有任意编织拓扑的例外纽结和链环。我们的方法结合了辫理论与半全纯多项式,建立了辫词与非厄米布洛赫哈密顿量之间的直接对应关系。该框架能够在显式紧束缚哈密顿量中实现多种例外构型,包括环面纽结、双纽线纽结、非纤维纽结、双曲纽结和多分量链环。此外,我们展示了可控拓扑转变,其中例外纽结可以通过例外点的重新分布和重新连接连续解开,伴随瞬态例外链和谱复能量编织的变化。我们的结果为可编程非厄米纽结拓扑建立了一条通用途径,并为在光子、声学、力学和冷原子系统中探索纽结能带简并及其相关物理现象提供了一个多功能平台。

英文摘要

Exceptional knots and links represent a remarkable class of non-Hermitian metals in which exceptional degeneracies form knotted or linked manifolds in momentum space. Here, we report a universal construction framework for realizing exceptional knots and links with arbitrary braiding topology in 3D minimal two-band non-Hermitian systems. Our approach combines braid theory with semiholomorphic polynomials to establish a direct correspondence between braid words and non-Hermitian Bloch Hamiltonians. This framework enables the realization of a broad variety of exceptional configurations, including torus knots, lemniscate knots, nonfibred knots, hyperbolic knots, and multi-component links, within explicit tight-binding Hamiltonians. Furthermore, we demonstrate controllable topological transitions in which exceptional knots can be continuously untied through redistribution and reconnection of exceptional points, accompanied by transient exceptional chains and changes in spectral complex energy braiding. Our results establish a universal route toward programmable non-Hermitian knot topology and provide a versatile platform for exploring knotted band degeneracies and their associated physical phenomena across photonic, acoustic, mechanical, and cold-atom systems.

2504.05237 2026-06-19 quant-ph cond-mat.quant-gas cond-mat.stat-mech hep-th 版本更新 80%

Measuring Rényi entropy with an Echo Protocol

用回波协议测量Rényi熵

Yi-Neng Zhou, Robin Löwenberg, Julian Sonner

专题命中 物理仿真 :提出测量Rényi熵的回波协议,用于量子多体系统

AI总结 提出基于回波型前向-后向演化序列的协议,通过跃迁概率表达纯度,高效测量第二Rényi熵,适用于量子多体系统,无需随机噪声平均。

Comments 19 pages, 15 figures

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AI中文摘要

我们提出了高效且实用的协议来测量第二Rényi熵,其指数称为纯度。我们的方法基于将纯度表示为由回波型前向-后向演化序列生成的跃迁概率,使其适用于量子多体系统。值得注意的是,我们的方法不依赖于随机噪声平均,这一特性可以扩展到测量无序时间关联函数的协议中,正如我们所展示的。通过示例,我们表明我们的协议可以在基于超导量子比特的平台以及腔QED囚禁超冷气体中实际实现。

英文摘要

We present efficient and practical protocols to measure the second Rényi entropy, whose exponential is known as the purity. Our approach is based on expressing the purity in terms of transition probabilities generated by an echo-type forward-backward evolution sequence, making it applicable to quantum many-body systems. Notably, our approach does not rely on random-noise averaging, a feature that can be extended to protocols to measure out-of-time-order correlation functions, as we demonstrate. By way of example, we show that our protocols can be practically implemented in superconducting qubit-based platforms, as well as in cavity-QED trapped ultra-cold gases.

2602.03244 2026-06-19 physics.hist-ph physics.chem-ph physics.class-ph 版本更新 80%

Does classical thermodynamics need a third law? Securing the second law at absolute zero

热力学第三定律是一个不必要的复杂性

José-María Martín-Olalla

专题命中 物理仿真 :论证热力学第三定律冗余,理论物理

AI总结 本文通过重新审视能斯特-爱因斯坦争论,论证了能斯特热定理是第二定律的逻辑推论,因此第三定律作为独立公设是多余的。

Comments 3 figures, 1 table, 8800 words

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AI中文摘要

本文阐述了第二定律与第三定律之间关系的含义,并为能斯特热定理的逻辑冗余提供了全面的形式和历史论证。通过重新审视能斯特-爱因斯坦争论,考察了导致传统上将第三定律视为独立假设的潜在假设。本文认为,历史上对能斯特证明的拒绝——源于爱因斯坦坚持在绝对零度下循环在实践上不可执行——忽略了普遍的第二定律已经排除了这种循环的事实,使得独立的第三定律成为不必要的复杂性。最终,能斯特定理被证明是一个基本的自洽调节器,而非独立的物理发现。

英文摘要

This paper elaborates on the implications of the relationship between the Second and Third Laws and provides a comprehensive formal and historical justification for the logical redundancy of the Nernst heat theorem. By revisiting the Nernst-Einstein debate, the underlying hypotheses that lead to the traditional view of the Third Law as an independent postulate are examined. It is argued that the historical rejection of Nernst's proof -- motivated by Einstein's insistence on the practical non-performability of cycles at absolute zero -- overlooks the fact that a universal Second Law already precludes such cycles, rendering an independent Third Law an unnecessary complexity. Ultimately, the Nernst theorem is shown to be an essential consistency regulator rather than an independent physical discovery.

2602.02466 2026-06-19 quant-ph math-ph math.MP 版本更新 80%

Resolving problems with the continuum limit in coherent-state path integrals

解决相干态路径积分中的连续极限问题

Oliwier Urbański

专题命中 物理仿真 :解决相干态路径积分连续极限问题

AI总结 针对玻色子热相干态路径积分中的连续极限问题,通过构造精确离散版本并比较不同排序的连续极限,证明Weyl排序适用于所有多项式哈密顿量,并利用重整化方法给出一般性证明。

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AI中文摘要

本文解决了玻色子热相干态路径积分中的连续极限问题。为此,针对哈密顿量的三种不同排序(正规序、反正规序和对称序(Weyl序))构造了路径积分的精确离散版本。随后,在谐振子上检验了它们的不同连续版本,以选择对称序作为所有多项式哈密顿量的可能正确选择。简单情况中发现的数学微妙之处为一般解提供了线索。最后,通过在虚时频域中使用重整化程序从精确离散情况推导连续路径积分,为对称序提供了普遍证明。虽然Weyl序的作用已被发现,但本文提供了其适用于每个多项式哈密顿量的缺失证明,并通过仅涉及产生和湮灭算符(不含位置和动量算符)简化了先前建立的构造。

英文摘要

The paper solves the problem of continuum limit in bosonic thermal coherent-state path integrals. For this purpose, exact discrete versions of the path integral are constructed for three different orderings of the Hamiltonian: normal, anti-normal and symmetric (Weyl order). Subsequently, their different continuum versions are checked on the harmonic oscillator, to choose the symmetric ordering as a possibly correct choice for all polynomial Hamiltonians. Spotted mathematical subtleties in the simple case serve as a clue to the general solution. Finally, a general justification for the symmetric order is provided by deriving the continuum path integral starting from the exact discrete case using a renormalization procedure in the imaginary time frequency domain. While the role of Weyl order has already been found, the paper provides the missing proof of its suitability for every polynomial Hamiltonian and simplifies the previously established construction by referring only to creation and annihilation operators (without position and momentum operators).

2602.01929 2026-06-19 math.DS stat.CO stat.ML 版本更新 80%

Probabilistic function-on-function nonlinear autoregressive model for emulation and reliability analysis of stochastic dynamical systems

概率函数对函数非线性自回归模型用于随机动力系统的仿真与可靠性分析

Zhouzhou Song, Marcos A. Valdebenito, Styfen Schär, Stefano Marelli, Bruno Sudret, Matthias G. R. Faes

专题命中 物理仿真 :提出概率模型用于随机动力系统仿真

AI总结 提出F2NARX模型,从函数对函数回归角度改进NARX方法,结合PCA和高斯过程回归实现概率预测,并通过主动学习高效估计首次穿越失效概率。

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AI中文摘要

在许多工程领域,构建准确且计算高效的代理模型(或仿真器)用于预测动力系统响应至关重要,但由于外部激励和系统参数到系统响应的强非线性和高维映射,这仍然具有挑战性。本文引入了一种新颖的函数对函数非线性自回归外生输入模型(F2NARX),该模型从函数对函数回归的角度重新表述了最近提出的$\mathcal{F}$-NARX方法。所提出的框架在保持高精度的同时显著提高了预测效率。通过将主成分分析与高斯过程回归相结合,F2NARX进一步通过无迹变换以自回归方式实现动力响应的概率预测。这种概率预测能力进一步促进了首次穿越概率评估的主动学习。通过不同复杂度的案例研究证明了该方法的有效性。结果表明,F2NARX在效率上比最先进的NARX模型高出几个数量级,同时通常达到更高的精度。此外,主动学习方法能够仅使用少量训练时间历程准确估计动力系统的首次穿越失效概率。

英文摘要

Constructing accurate and computationally efficient surrogate models (or emulators) for predicting dynamical system responses is critical in many engineering domains, yet remains challenging due to the strongly nonlinear and high-dimensional mapping from external excitations and system parameters to system responses. This work introduces a novel Function-on-Function Nonlinear AutoRegressive model with eXogenous inputs (F2NARX), which reformulates the recently proposed $\mathcal{F}$-NARX method from a function-on-function regression perspective. The proposed framework substantially improves predictive efficiency while maintaining high accuracy. By combining principal component analysis with Gaussian process regression, F2NARX further enables probabilistic predictions of dynamical responses via the unscented transform in an autoregressive manner. Such probabilistic prediction capabilities further facilitate active learning for first-passage probability evaluation. The effectiveness of the method is demonstrated through case studies of varying complexity. Results show that F2NARX outperforms state-of-the-art NARX model by orders of magnitude in efficiency while achieving higher accuracy in general. Meanwhile, the active learning approach enables accurate estimation of first-passage failure probabilities for dynamical systems using only a small number of training time histories.

2602.00345 2026-06-19 math.AP math-ph math.MP 版本更新 80%

Three self-similar solutions of Yang-Mills equations in high odd dimensions

高奇数维杨-米尔斯方程的三个自相似解

Piotr Bizoń, Irfan Glogić, Arthur Wasserman

专题命中 物理仿真 :杨-米尔斯方程自相似解,理论物理

AI总结 本文研究高奇数维闵可夫斯基时空中SO(d)规范群的球对称杨-米尔斯方程,证明存在恰好N个光滑自相似解,并发现对于所有奇数d≥11,N=3,其中两个解具有闭式表达式。

Comments 11 pages, 1 figure; content essentially unchanged but rearranged and expanded in places

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AI中文摘要

我们考虑$d+1$维闵可夫斯基时空中规范群为$SO(d)$的球对称杨-米尔斯方程。对于任意给定的奇数$d\geq 11$,我们证明了恰好存在$N$个光滑自相似解(模反射对称性),其中$N$是显式多项式$P_m(z)$(次数$m=(d-5)/2$)在区间$0<z<1$内零点的个数。$N$可以通过显式计算算法确定。我们对大奇数维的广泛计算表明,对于所有奇数$d\geq 11$,$N=3$。其中两个自相似解具有闭式表达式:一个先前已知,另一个似乎是新的。我们的结果指向高维杨-米尔斯方程可能的爆破情景相对简单的图景。除了纯数学兴趣外,这种自相似爆破的刚性可能也与物理相关,因为它限制了在弦理论启发的额外维设置和全息模型中出现的更高维杨-米尔斯理论中非阿贝尔规范场的可能紫外动力学。

英文摘要

We consider spherically symmetric Yang-Mills equations with gauge group $SO(d)$ in $d+1$ dimensional Minkowski spacetime. For any given odd $d\geq 11$, we establish existence and uniqueness (modulo reflection symmetry) of exactly $N$ smooth self-similar solutions, where $N$ is the number of zeros of an explicit polynomial $P_m(z)$ of degree $m=(d-5)/2$ in the interval $0<z<1$. The number $N$ can be determined algorithmically by an explicit computation. Our extensive computations for large odd dimensions suggest that $N=3$ for all odd $d\geq 11$. Two of these self-similar solutions admit closed-form expressions: one has been known previously, while the other appears to be new. Our result points toward a relatively simple landscape of possible blowup scenarios for high-dimensional Yang-Mills equations. Beyond its purely mathematical interest, this rigidity of self-similar blowup may also be relevant from a physical perspective, as it constrains the possible ultraviolet dynamics of non-abelian gauge fields in higher-dimensional Yang-Mills theories arising in string-inspired extra-dimensional setups and in holographic models.

2512.17996 2026-06-19 cond-mat.str-el cond-mat.supr-con hep-th 版本更新 80%

Non-Abelian topological superconductivity from melting Abelian fractional Chern insulators

非阿贝尔拓扑超导电性:来自熔化阿贝尔分数量子陈绝缘体

Zhengyan Darius Shi, T. Senthil

专题命中 物理仿真 :研究分数量子陈绝缘体到超导体的相变

AI总结 本文通过理论框架揭示,通过调节带宽,阿贝尔分数量子陈绝缘体(ν=2/3)可相变为五种超导体,其中一些具有非阿贝尔特性并支持马约拉纳零模,预测了更一般填充分数下的新奇超导态。

Comments 6 pages, 2 figures, 6 pages of appendices. v2: updated refs and added section on doping-induced FCI-SC transitions

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AI中文摘要

分数量子陈绝缘体(FCI)是在陈能带部分填充时实现的奇异物质相,承载分数电荷的任意子激发。最近的几个微观模型数值研究表明,增加FCI的带宽可以驱动直接相变为电荷-2e超导体,而非传统的费米液体。受这一惊人观察的启发,我们提出了一个理论框架,捕捉了晶格中超导电性与分数化之间的交织。利用Jain拓扑序的三种场论描述之间的对偶性,我们发现带宽调节可以将ν=2/3的单一母体FCI驱动为五种不同的超导体,其中一些本质上是非阿贝尔的并支持马约拉纳零模。我们的结果揭示了一个没有正常态费米面的奇异超导体的丰富图景,并预测了在更一般的填充分数ν=p/(2p+1)下,与中性非阿贝尔拓扑序共存的新型高电荷超导体。

英文摘要

Fractional Chern insulators (FCI) are exotic phases of matter realized at partial filling of a Chern band that host fractionally charged anyon excitations. Recent numerical studies in several microscopic models reveal that increasing the bandwidth in an FCI can drive a direct transition into a charge-2e superconductor rather than a conventional Fermi liquid. Motivated by this surprising observation, we propose a theoretical framework that captures the intertwinement between superconductivity and fractionalization in a lattice setting. Leveraging the duality between three field-theoretic descriptions of the Jain topological order, we find that bandwidth tuning can drive a single parent FCI at $ν= 2/3$ into five different superconductors, some of which are intrinsically non-Abelian and support Majorana zero modes. Our results reveal a rich landscape of exotic superconductors with no normal state Fermi surface and predict novel higher-charge superconductors coexisting with neutral non-Abelian topological order at more general filling fractions $ν= p/(2p+1)$.

2512.01538 2026-06-19 physics.chem-ph physics.optics 版本更新 80%

Quantized plasmon modes for metallic nanoparticles of arbitrary shape with a generic dielectric function

具有通用介电函数的任意形状金属纳米颗粒的量子化等离激元模式

Marco Romanelli, Gabriel Gil, Stefano Corni

专题命中 物理仿真 :量子化等离激元模式,属于物理仿真

AI总结 提出一种基于实验介电函数、适用于任意形状金属纳米颗粒的等离激元模式量子化方法,正确再现准静态极限下的宏观极化,并实现与量子化学分子描述的耦合,为精确建模强耦合等离激元-分子系统奠定基础。

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AI中文摘要

在这项工作中,我们引入了一种有效的方法来量子化等离激元金属纳米结构的电磁响应。它们的形状是任意的,并且具有基于实验数据的频率相关金属介电函数的真实描述。导出的量子模式正确地再现了在准静态极限下根据经典宏观麦克斯韦方程,纳米颗粒在外部驱动下的线性响应宏观极化。我们进一步研究了这些模式与量子化学分子描述的耦合。所提出的方法为精确建模等离激元-分子耦合系统铺平了道路,其中强等离激元-分子耦合和/或强驱动场要求对等离激元响应进行量子化描述。

英文摘要

In this work we introduce an effective approach to quantize the electromagnetic response of plasmonic metallic nanostructures. Their shape is arbitrary and they feature a realistic description of the frequency-dependent metal dielectric function that is based on experimental data. The derived quantum modes correctly reproduce the linear response macroscopic polarization of the nanoparticle upon external drive according to classical macroscopic Maxwell equations in the quasistatic limit. We further investigate the coupling of these modes to a quantum-chemical molecular description. The presented methodology paves the way for accurate modeling of plexcitonic system, where strong plasmon-molecule coupling and/or strong-driving fields call for a quantized description of the plasmonic response.

2509.10705 2026-06-19 cond-mat.stat-mech cond-mat.dis-nn cond-mat.soft physics.bio-ph 版本更新 80%

Metastable phase separation and information retrieval in multicomponent mixtures

多组分混合物中的亚稳态相分离与信息检索

Rodrigo Braz Teixeira, Davide Marcato, Izaak Neri, Pablo Sartori

专题命中 物理仿真 :研究多组分混合物中的亚稳态相分离

AI总结 本文发展了亚稳态相分离的热力学形式,应用于高阶相互作用二元混合物,并重点研究霍普菲尔德液体中的亚稳态相分离及其信息检索能力。

Comments 26 pages, 8 figures, 16 pages of supplement

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AI中文摘要

液体混合物可以分离成具有不同组成的相。由于其在复杂生物液体(如细胞质)中的作用,这一现象最近重新引起关注,这些液体包含数千种组分。对于简单的双组分混合物,相分离状态是全局自由能最小值。然而,局部自由能最小值,即亚稳态,已知在具有许多组分的复杂系统中起主导作用。例如,霍普菲尔德神经网络可以通过松弛到亚稳态从部分线索中检索信息。在什么条件下相分离状态可以是亚稳态的,这对多组分液体中的信息处理有何影响?在这项工作中,我们发展了亚稳态相分离的一般热力学形式。然后,我们将这种形式应用于一个受近期实验启发的说明性玩具示例,即具有高阶相互作用的二元混合物。最后,作为该形式的核心应用,我们研究了霍普菲尔德液体中的亚稳态,这是一类能够存储关于相组成信息的多组分混合物。我们表明,这些相可以通过亚稳态相分离从部分线索中检索出来。具有大量组分的液体的空间模拟与我们的解析解相匹配。我们的工作表明,复杂的生物混合物可以通过亚稳态相分离执行信息检索。

英文摘要

Liquid mixtures can separate into phases with distinct composition. This phenomenon has recently come back to prominence due to its role in complex biological liquids, such as the cytoplasm, which contain thousands of components. For simple two-component mixtures phase-separated states are global free energy minima. However, local free energy minima, i.e. metastable states, are known to play a dominant role in complex systems with many components. For example, Hopfield neural networks can retrieve information from partial cues via relaxation to metastable states. Under what conditions can phase separated states be metastable, and what are the implications for information processing in multicomponent liquids? In this work we develop the general thermodynamic formalism of metastable phase separation. We then apply this formalism to an illustrative toy example inspired by recent experiments, binary mixtures with high-order interactions. Finally, as core application of the formalism, we study metastability in Hopfield liquids, a class of multicomponent mixtures capable of storing information on the composition of phases. We show that these phases can be retrieved from partial cues via metastable phase separation. Spatial simulations of liquids with a large number of components match our analytical solution. Our work suggests that complex biological mixtures can perform information retrieval through metastable phase separation.

2512.06939 2026-06-19 math.AG math.OC physics.chem-ph 版本更新 80%

Numerical Algebraic Geometry for Energy Computations on Tensor Train Varieties

张量列簇上能量计算的数值代数几何

Viktoriia Borovik, Hannah Friedman, Serkan Hoşten, Max Pfeffer

专题命中 物理仿真 :数值代数几何用于量子化学能量计算

AI总结 利用计算代数几何研究量子化学中的能量最小化问题,通过同伦连续法计算张量列簇上的所有临界点,并引入Rayleigh-Ritz判别式,为交替线性方案和密度矩阵重整化群方法提供基准。

Comments 32 pages

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AI中文摘要

我们通过计算代数几何的视角研究量子化学中的能量最小化问题。我们专注于在张量列簇上最小化哈密顿量的瑞利商。该问题的复临界点近似量子系统的本征态,全局最小值近似基态。我们将临界点的数量称为瑞利-里兹度。我们首先研究瑞利-里兹度,并引入瑞利-里兹判别式,该判别式描述导致临界点数量不足的哈密顿量。然后,我们将此框架专门应用于张量列簇:我们识别出它们是射影空间的Segre积的情况,报告了关于其定义理想的已知信息,并给出了来自格拉斯曼积的双有理参数化。我们使用同伦连续法计算了各种张量列簇和行列式簇上该优化问题的所有临界点。最后,我们利用这些结果对最先进的方法——交替线性方案和密度矩阵重整化群——进行基准测试。

英文摘要

We study energy minimization problems in quantum chemistry through the lens of computational algebraic geometry. We focus on minimizing the Rayleigh quotient of a Hamiltonian over a tensor train variety. The complex critical points of this problem approximate eigenstates of the quantum system, with the global minimum approximating the ground state. We call the number of critical points the Rayleigh-Ritz degree. We first study the Rayleigh-Ritz degree and introduce the Rayleigh-Ritz discriminant, which describes Hamiltonians that lead to a deficient number of critical points. We then specialize this framework to tensor train varieties: we identify instances when they are Segre products of projective spaces, report what we know about their defining ideals, and present a birational parametrization from products of Grassmannians. We use homotopy continuation to compute all critical points of this optimization problem over various tensor train and determinantal varieties. Finally, we use these results to benchmark state-of-the-art methods, the Alternating Linear Scheme and Density Matrix Renormalization Group.

2511.23301 2026-06-19 quant-ph cond-mat.other 版本更新 80%

Inhibited radiative decay enhances single-photon emitters

抑制辐射衰变增强单光子发射体

Florian Burger, Stephan Rinner, Andreas Gritsch, Kilian Sandholzer, Andreas Reiserer

专题命中 物理仿真 :利用光子带隙抑制衰变增强单光子发射体,量子光学。

AI总结 提出利用光子带隙抑制非期望衰变路径,增强单光子发射体在目标跃迁上的辐射,避免对高品质因子微腔的依赖,实现大频率范围内的高效光子收集和数十个掺铒离子的分辨与寻址。

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AI中文摘要

量子网络和模块化量子计算机需要高效的自旋-光子接口,通常通过光学谐振腔增强目标跃迁上的辐射衰变来实现。然而,这需要小模式体积和高品质因子,限制了复用能力并需要精确的频率调谐。在这里,我们展示了一种替代方法,规避了这些扩展瓶颈。利用具有定制光子带隙的W1硅光子晶体波导,我们选择性地抑制非期望的衰变路径,从而将发射重定向到目标跃迁。这使得在大频率范围内实现高效光子收集成为可能,从而能够分辨和单独寻址数十个掺铒离子。与体材料相比,它们的寿命得以保持甚至增加。器件的扩展模式体积允许使用更低的掺杂浓度,从而改善发射体相干性。我们的方法可以与Purcell增强相结合,并应用于其他自旋量子比特平台,为光子量子技术开辟了有趣的前景。

英文摘要

Quantum networks and modular quantum computers require efficient spin-photon interfaces, often realized using optical resonators that enhance radiative decay on a desired transition. However, this requires small mode volumes and high quality factors, which limits multiplexing capacity and demands precise frequency tuning. Here, we demonstrate an alternative approach that circumvents these bottlenecks for upscaling. Using a W1 silicon photonic crystal waveguide with a tailored photonic bandgap, we selectively inhibit unwanted decay pathways, thereby redirecting emission to the desired transition. This enables efficient photon collection over a large frequency range, allowing the resolution and individual addressing of tens of erbium dopants. Their lifetimes are preserved, or even increased, compared to bulk material. The extended mode volume of the devices enables the use of lower dopant concentrations, thereby improving emitter coherence. Our approach can be combined with Purcell enhancement and applied to other spin-qubit platforms, opening intriguing perspectives for photonic quantum technologies.

2511.13470 2026-06-19 math-ph cond-mat.mes-hall math.AP math.CA math.FA math.MP 版本更新 80%

Magnetic Double-Wells: Lower Bounds on Tunneling

磁双阱:隧穿的下界

Charles L. Fefferman, Jacob Shapiro, Michael I. Weinstein

专题命中 物理仿真 :研究强磁场双阱系统的隧穿率下界,数学物理。

AI总结 研究强磁场和深势阱下的双阱系统,给出一般耦合常数下隧穿率的下界,补充了之前特殊构造中隧穿消失的反例。

Comments With an appendix by Tal Shpigel, 81 pages

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AI中文摘要

我们研究了具有强磁场和深势阱的双阱系统。对于一般耦合常数值,我们给出了隧穿率的下界。这一结果最近被宣布,并补充了我们最近的反例构造,该构造展示了在特殊构造的双阱势中隧穿消失的现象。

英文摘要

We study double-well systems with strong magnetic fields and deep potential wells. We present lower bounds on tunneling rates for generic values of the coupling constant. This result was recently announced and complements our recent counter-example construction which exhibits vanishing tunneling for specially-constructed double-well potentials.

2510.12307 2026-06-19 math.NA cs.NA 版本更新 80%

Fully mixed virtual element schemes for a new model of steady-state poroelastic stress-assisted diffusion in the brain

脑稳态孔隙弹性应力辅助扩散新模型的完全混合虚拟元方案

Isaac Bermudez, Bryan Gomez-Vargas, Kent-Andre Mardal, Andres E. Rubiano, Ricardo Ruiz-Baier

专题命中 物理仿真 :提出虚拟元法求解脑孔隙弹性与扩散耦合问题

AI总结 提出完全混合虚拟元法求解线性孔隙弹性与应力依赖非线性扩散的耦合问题,通过解耦不动点策略证明解存在性,并建立先验误差估计,数值实验验证了最优收敛性和参数鲁棒性。

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AI中文摘要

我们提出了一种完全混合虚拟元方法,用于数值逼近线性孔隙弹性方程(使用Hellinger--Reissner原理,具有总孔隙弹性应力的强对称性)与应力改变溶质扩散(其中扩散通量依赖于孔隙弹性应力并非线性依赖于浓度梯度)之间的耦合。由于非线性耦合,与非线性扩散子问题相关的函数空间是Banach型的。为了处理这种结构,通过解耦的不动点策略建立了连续和离散问题的可解性。线性孔隙弹性部分使用扰动鞍点问题理论进行分析,而非线性扩散问题则依赖于单调全局算子的经典Minty--Browder定理。通过Schauder不动点定理严格证明了完全耦合系统解的存在性。此外,我们为离散方案建立了严格的先验误差估计,成功处理了强交叉耦合的非线性。这些发现得到了计算证据的支持,表明该公式在实践中渐近地恢复了最优收敛速度。作为关键贡献,数值方案及其基础分析在孔隙力学参数方面被证明是鲁棒的。最后,给出了几个数值例子,以说明所提出方案在脑多物理场背景下溶质输运研究中的特性和适用性。

英文摘要

We propose a fully mixed virtual element method for the numerical approximation of the coupling between linear poroelasticity equations with strong symmetry of total poroelastic stress (using the Hellinger--Reissner principle) and stress-altered solute diffusion (where diffusive flux depends on the poroelastic stress and nonlinearly on the concentration gradient). Because of the nonlinear coupling, the function spaces associated with the nonlinear diffusion sub-problem are of Banach type. To handle this structure, the solvability of both the continuous and discrete problems is established through a decoupled fixed-point strategy. The linear poroelasticity component is analysed using the theory for perturbed saddle-point problems, whereas the nonlinear diffusion problem, relies on the classical Minty--Browder theorem for monotone global operators. The existence of solutions for the fully coupled system is rigorously proven via Schauder's fixed-point theorem. Additionally, we establish rigorous a priori error estimates for the discrete scheme, successfully handling the strongly cross-coupled nonlinearities. These findings are supported by computational evidence, demonstrating that the formulation asymptotically recovers optimal convergence rates in practice. As a key contribution, both the numerical scheme and its underlying analysis prove to be robust with respect to the poromechanical parameters. Finally, several numerical examples are presented to illustrate the properties and applicability of the proposed scheme in the study of solute transport in the context of brain multiphysics.

2508.13313 2026-06-19 stat.ML cs.LG math.OC 版本更新 80%

Flow Matching for Efficient and Scalable Data Assimilation

用于高效可扩展数据同化的流匹配

Taos Transue, Bohan Chen, So Takao, Bao Wang

发表机构 * The Computing and Mathematical Sciences Department, California Institute of Technology(加州理工学院计算与数学科学系) Department of Mathematics and Scientific Computing and Imaging Institute, University of Utah(犹他大学数学与科学计算系和成像研究所)

专题命中 物理仿真 :流匹配用于数据同化,加速高维非线性状态估计

AI总结 提出基于流匹配的无训练集成流滤波器(EnFF),通过蒙特卡洛估计和局部化引导加速高维非线性数据同化,在成本-精度权衡和可扩展性上优于现有方法。

Comments revamp presentation, add experiments

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AI中文摘要

数据同化(DA)从含噪声观测中估计动态系统的状态。最近的生成模型如集成得分滤波器(EnSF)改进了高维非线性设置下的DA,但计算成本高。我们引入集成流滤波器(EnFF),一种基于流匹配(FM)的无训练框架,加速采样并提供流设计灵活性。EnFF使用边际流场的蒙特卡洛估计器、用于观测同化的局部化引导,并利用一种利用贝叶斯DA公式的新型流路径。它推广了经典滤波器如自举粒子滤波器和集成卡尔曼滤波器。在高维基准上的实验证明了EnFF改进的成本-精度权衡和可扩展性,突显了FM在高效、可扩展DA中的潜力。代码见 https://this URL。

英文摘要

Data assimilation (DA) estimates a dynamical system's state from noisy observations. Recent generative models like the ensemble score filter (EnSF) improve DA in high-dimensional nonlinear settings but are computationally expensive. We introduce the ensemble flow filter (EnFF), a training-free, flow matching (FM)-based framework that accelerates sampling and offers flexibility in flow design. EnFF uses Monte Carlo estimators for the marginal flow field, localized guidance for observation assimilation, and utilizes a novel flow path that exploits the Bayesian DA formulation. It generalizes classical filters such as the bootstrap particle filter and ensemble Kalman filter. Experiments on high-dimensional benchmarks demonstrate EnFF's improved cost-accuracy tradeoffs and scalability, highlighting FM's potential for efficient, scalable DA. Code is available at https://github.com/Utah-Math-Data-Science/Data-Assimilation-Flow-Matching.

2501.15976 2026-06-19 math.NA cs.NA 版本更新 80%

Theory of two-level Schwarz preconditioners with piecewise-polynomial coarse spaces for the high-frequency Helmholtz equation

高频亥姆霍兹方程的分段多项式粗空间两级Schwarz预条件子理论

Ivan G. Graham, Euan A. Spence

专题命中 物理仿真 :分析高频亥姆霍兹方程两级Schwarz预条件子

AI总结 针对大波数亥姆霍兹方程的有限元离散,分析经典两级加性Schwarz区域分解GMRES预条件子,其中细空间和粗空间均为分段多项式,多项式次数随log k增长,证明迭代次数与k无关。

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AI中文摘要

我们分析了经典的两级加性Schwarz区域分解GMRES预条件子,用于大波数$k$的亥姆霍兹方程的有限元离散,其中细空间和粗空间均由分段多项式构成,多项式次数随$\log k$增长。我们展示了这些细空间和粗空间的选择,使得——在$\log k$的因子范围内——两者均无污染(粗空间维度与细空间维度之比任意小),每个子域的自由度数为常数,并且GMRES迭代次数被证明与$k$无关。这是关于高频亥姆霍兹方程的两级Schwarz预条件子的首个$k$显式收敛结果,其中粗空间无污染且不包含问题自适应基函数。

英文摘要

We analyse the classic two-level additive Schwarz domain-decomposition GMRES preconditioner for finite-element discretisations of the Helmholtz equation with large wavenumber $k$, where both the fine and coarse spaces consist of piecewise polynomials with polynomial degree increasing like $\log k$. We exhibit choices of these fine and coarse spaces such that -- up to factors of $\log k$ -- both are pollution free (with the ratio of the coarse-space dimension to the fine-space dimension arbitrarily small), the number of degrees of freedom per subdomain is constant, and the number of GMRES iterations is proved to be bounded independently of $k$. These are the first $k$-explicit convergence results about a two-level Schwarz preconditioner for high-frequency Helmholtz with a coarse space that is pollution free and does not consist of problem-adapted basis functions.

2506.24079 2026-06-19 quant-ph cond-mat.stat-mech hep-th math-ph math.MP 版本更新 80%

Maximum entropy principle for quantum processes

量子过程的最大熵原理

Siddhartha Das, Ujjwal Sen

专题命中 物理仿真 :量子过程最大熵原理,属于物理仿真。

AI总结 将最大熵原理从静态量子态扩展到动态量子过程,证明在固定能量约束下,量子信道达到最大输出熵当且仅当它是绝对热化信道,并探讨其在私有随机性蒸馏中的应用。

Comments Close to published version; See [arXiv:2510.12790; arXiv:2604.01217] for applications

Journal ref Journal of Physics A: Mathematical and Theoretical, vol. 59, no. 24, page 245309, June 2026

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AI中文摘要

最大熵原理应用于量子系统时,是一个基本准则,认为对于只有部分知识的量子系统,与部分知识一致的最大熵状态是系统状态的一个有价值选择。一个有趣的结果是,如果唯一的先验知识是固定能量,那么最大熵状态就是热态,这是统计力学等多个领域中普遍存在的状态。我们将这一原理的结论从静态量子态扩展到动态量子过程。我们证明,在固定能量约束下,量子信道达到最大输出熵当且仅当它是绝对热化信道,其中固定输出是对应于该能量的热态。我们的结果对于理解物理约束下量子信道的信息和热力学效用具有潜在意义。作为一个应用,我们考察了从固定能量约束的量子过程中蒸馏私有随机性的后果。

英文摘要

The maximum entropy principle, as applied to quantum systems, is a fundamental prescript positing that for a quantum system for which we only have partial knowledge, the maximum entropy state consistent with the partial knowledge is a valuable choice as the system's state. An intriguing result is that in case the only prior knowledge is of a fixed energy, the maximum entropy state turns out to be the thermal state, a ubiquitous state in several arenas, especially in statistical mechanics. We extend the consequences of this principle from static quantum states to dynamic quantum processes. We establish that a quantum channel attains maximal output entropy under a fixed energy constraint if and only if it is an absolutely thermalizing channel, where the fixed output is the thermal state corresponding to that energy. Our results have potential implications for understanding the informational and thermodynamic utility of quantum channels under physical constraints. As an application, we examine the consequences for private randomness distillation from fixed energy constrained quantum processes.

2507.06474 2026-06-19 cond-mat.supr-con cond-mat.mes-hall 版本更新 80%

Gap reopening as a possible signature of coupling between Majorana zero modes in Sn-(Bi,Sb)2(Te,S)3-based Josephson trijunctions

Sn-(Bi,Sb)2(Te,S)3基约瑟夫森三结中能隙重新打开作为马约拉纳零模耦合的可能特征

Duolin Wang, Xiang Zhang, Yunxiao Zhang, Heng Zhang, Fucong Fei, Xiang Wang, Bing Li, Xiaozhou Yang, Yukun Shi, Zhongmou Jia, Enna Zhuo, Yuyang Huang, Anqi Wang, Zenan Shi, Zhaozheng Lyu, Xiaohui Song, Peiling Li, Bingbing Tong, Ziwei Dou, Jie Shen, Guangtong Liu, Fanming Qu, Fengqi Song, Li Lu

专题命中 物理仿真 :马约拉纳零模耦合研究,属于物理仿真。

AI总结 在Sn-(Bi,Sb)2(Te,S)3表面制备相邻约瑟夫森三结器件,观察到两结中微隙重新打开,可能源于马约拉纳零模耦合,为Fu-Kane拓扑量子计算方案提供实验支持。

Comments 4 figures

Journal ref Physical Review B 113, 235424 (2026)

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AI中文摘要

在过去的二十年中,人们付出了巨大的努力来寻找实现拓扑量子计算(TQC)的可能平台和方案。在探索基于拓扑绝缘体上约瑟夫森三结的Fu-Kane TQC方案时,单个三结中预测的马约拉纳相图已在实验上得到验证。如果这种三结中确实存在马约拉纳零模,那么多个三结器件中它们之间的耦合应该是可以预期的。在本研究中,我们在Sn-(Bi, Sb)2(Te, S)3表面制备了包含两个相邻约瑟夫森三结的器件,并观察到了耦合效应的一个可能特征,表现为两个三结中微隙的重新打开,而如果三结单独存在,则预期会观察到微隙闭合。虽然不能完全排除其他解释,但我们的发现为Fu-Kane理论的有效性提供了实验支持,并为进一步推进Fu和Kane提出的TQC方案提供了动力。

英文摘要

In the past two decades, enormous efforts have been made to search for possible platforms and schemes to implement topological quantum computation (TQC). In exploring the Fu-Kane scheme of TQC based on Josephson trijunctions constructed on topological insulators, the predicted Majorana phase diagram of an individual trijunction has already been verified experimentally. If Majorana zero modes indeed exist in this kind of trijunction, coupling between them in multiple trijunction devices should be further expected. In this study, we fabricated Josephson devices containing two adjacent Josephson trijunctions on the surface of Sn-(Bi, Sb)2(Te, S)3 and observed a possible signature of the coupling effect manifesting as the reopening of a minigap in both trijunctions where a closure would otherwise be expected if the trijunctions existed individually. While alternative interpretations cannot be fully ruled out, our findings provide experimental support for the validity of the Fu-Kane theory and provide further motivation for advancing the TQC scheme proposed by Fu and Kane.

2503.05686 2026-06-19 math.AP 版本更新 80%

First order non-instantaneous corrections in collisional kinetic alignment models

碰撞动力学对齐模型中的一阶非瞬时修正

Laura Kanzler, Carmela Moschella, Christian Schmeiser

专题命中 物理仿真 :碰撞动力学对齐模型修正,属于物理仿真。

AI总结 本文提出并研究高阶非瞬时对齐碰撞模型,推导出瞬时极限的一阶精确近似修正,证明其适定性和瞬时极限的严格结果。

Comments 17 pages

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AI中文摘要

在这项工作中,标准动力学理论中瞬时碰撞的假设被放宽。作为Kanzler、Schmeiser和Tora [KRM, 2024]先前论文的延续,本文提出并研究了一个高阶非瞬时对齐碰撞模型,并在短碰撞持续时间的渐近区域中进行分析。推导出一阶精确近似模型作为瞬时极限的修正。证明了该近似模型的适定性以及瞬时极限的严格结果。该近似模型是一个由两个方程组成的系统。还提出了一个同样精确的标量近似。

英文摘要

In this work the standard kinetic theory assumption of instantaneous collisions is lifted. As a continuation of of a previous paper by Kanzler, Schmeiser, and Tora [KRM, 2024], a model for higher order non-instantaneous alignment collisions is presented and studied in the asymptotic regime of short collision duration. A first order accurate approximative model is derived as a correction to the instantaneous limit. Rigorous results on its well-posedness and on the instantaneous limit are proven. The approximative model is a system of two equations. An equally accurate scalar approximation is suggested.

2503.17386 2026-06-19 eess.SY cs.LG cs.SY 版本更新 80%

A graph neural network surrogate model for mesh-based crashworthiness prediction of vehicle panel components

基于图神经网络的网格级车辆面板部件耐撞性预测代理模型

Haoran Li, Yingxue Zhao, Haosu Zhou, Tobias Pfaff, Nan Li

发表机构 * Dyson School of Design Engineering, Imperial College London(迪森设计工程学院,帝国理工学院伦敦分校) NVIDIA

专题命中 物理仿真 :用图神经网络代理模型预测车辆耐撞性

AI总结 提出递归图U-Net (ReGUNet) 代理模型,通过图表示有限元网格,结合层次架构和递归机制,高效准确预测车辆B柱等面板部件的动态变形和耐撞性指标。

Comments Accepted manuscript version. Final published version available in Results in Engineering via DOI: 10.1016/j.rineng.2026.110925

Journal ref Results in Engineering 30 (2026) 110925

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AI中文摘要

耐撞性是安全关键车辆面板部件(如B柱)设计中的关键性能指标。有限元(FE)模拟广泛用于评估碰撞响应,但对于大规模非线性碰撞场景,特别是当集成到迭代设计和优化过程中时,计算成本仍然很高。尽管基于机器学习的代理模型已被开发用于快速耐撞性分析,但它们在对复杂三维部件的详细表示方面存在局限性。图神经网络(GNN)已成为处理复杂结构数据的有前景的解决方案。然而,现有的GNN模型通常缺乏足够的精度和计算效率以满足工业需求。本文提出了递归图U-Net(ReGUNet),一种用于车辆面板部件耐撞性分析的基于图的代理模型。通过将有限元网格表示为图形式,该模型自然地适应复杂的非规则结构几何。其层次架构提高了计算效率和精度,而递归的引入增强了多时间步长上时间预测的稳定性。使用不同几何形状的热冲压钢B柱的侧面碰撞案例研究来生成训练数据集。训练后的模型在预测未见过的部件设计的动态变形行为和耐撞性指标方面表现出高精度。与基线方法相比,ReGUNet在平均变形预测误差上实现了超过52%的降低,同时计算效率显著提高。ReGUNet提供了快速可靠的耐撞性评估,从而加速了车辆面板部件的设计周期。

英文摘要

Crashworthiness is a key performance measure in the design of safety-critical vehicle panel components such as B-pillars. Finite element (FE) simulations are widely used to evaluate crash responses but remain computationally expensive for large-scale, nonlinear impact scenarios, particularly when integrated into iterative design and optimisation processes. Although machine learning-based surrogate models have been developed for rapid crashworthiness analysis, they exhibit limitations in detailed representation of complex 3-dimensional components. Graph Neural Networks (GNNs) have emerged as a promising solution for processing data with complex structures. However, existing GNN models often lack sufficient accuracy and computational efficiency to meet industrial demands. This paper proposes Recurrent Graph U-Net (ReGUNet), a graph-based surrogate model for crashworthiness analysis of vehicle panel components. By representing FE meshes in graph form, the model naturally accommodates complex irregular structural geometries. Its hierarchical architecture improves computational efficiency and accuracy, while the introduction of recurrence enhances stability of temporal predictions over multiple time steps. A side-impact case study of hot-stamped steel B-pillars with varying geometries is used to generate training dataset. The trained model demonstrates high accuracy in predicting the dynamic deformation behaviour and crashworthiness indicators of previously unseen component designs. ReGUNet achieves over a 52% reduction in the average deformation prediction error relative to baseline methods, together with markedly improved computational efficiency. ReGUNet provides rapid and reliable crashworthiness assessments, which in turn accelerates the design cycle of vehicle panel components.

2605.23799 2026-06-19 math.QA math.RA 版本更新 75%

Rota-Baxter Operators on Vertex Algebras in Integrated $λ$-Bracket Formalism and Their Associated 2-Cocycles

顶点代数上集成λ-括号形式中的Rota-Baxter算子及其关联的2-上循环

Hassan Alhussein

专题命中 物理仿真 :顶点代数上Rota-Baxter算子研究

AI总结 本文利用集成λ-括号形式研究顶点代数上的Rota-Baxter算子,该算子产生变形顶点代数结构,变形括号与原括号的差给出顶点代数上同调中的2-上循环,并刻画该2-上循环平凡的条件。

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AI中文摘要

我们利用集成λ-括号形式研究顶点代数上的Rota-Baxter算子。Rota-Baxter算子产生一个变形的顶点代数结构,变形括号与原括号的差给出顶点代数上同调中的一个二上循环。这推广了Rota-Baxter算子与Hochschild二上循环之间的经典关系。我们还刻画了该二上循环何时是平凡的,表明非标量算子产生非平凡的上同调类。

英文摘要

We study Rota--Baxter operators on vertex algebras using the integrated $λ$-bracket formalism. A Rota--Baxter operator produces a deformed vertex algebra structure, and the difference between the deformed and original brackets yields a two-cocycle in vertex algebra cohomology. This generalizes the classical relation between Rota--Baxter operators and Hochschild two-cocycles. We also characterize when this two-cocycle is trivial, showing that non-scalar operators give rise to non-trivial cohomology classes.

2. 其他科学智能 3 篇

2604.13240 2026-06-19 cs.CV cs.LG 版本更新 80%

A High-Resolution Landscape Dataset for Concept-Based XAI With Application to Species Distribution Models

基于概念的可解释AI的高分辨率景观数据集及其在物种分布模型中的应用

Augustin de la Brosse, Damien Garreau, Thomas Houet, Thomas Corpetti

发表机构 * Université Rennes 2, CNRS, Nantes Université, Univ Brest, LETG, UMR 6554(里昂大学第二分校、法国国家科学研究中心、南特大学、布列塔尼大学、LETG、UMR 6554) LTSER Zone Atelier Armorique(Armorique 领域实验室区) University of Würzburg, Center for Artificial Intelligence and Data Science(乌尔姆大学、人工智能与数据科学中心)

专题命中 其他科学智能 :可解释AI用于物种分布模型

AI总结 提出首个基于概念的可解释AI方法用于物种分布模型,利用高分辨率多光谱和LiDAR无人机影像构建景观概念数据集,通过Robust TCAV量化景观概念对模型预测的影响,案例研究验证了方法的有效性。

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AI中文摘要

绘制物种空间分布对于保护政策和入侵物种管理至关重要。物种分布模型(SDMs)是完成此任务的主要工具,具有两个目的:实现稳健的预测性能,同时提供关于分布驱动因素的生态见解。然而,深度学习SDMs日益增长的复杂性使得提取这些见解更具挑战性。为了调和这些目标,我们提出了首个基于概念的可解释AI(XAI)在SDMs中的实现。我们利用Robust TCAV(测试与概念激活向量)方法量化景观概念对模型预测的影响。为此,我们提供了一个新的开放获取的景观概念数据集,该数据集源自高分辨率多光谱和LiDAR无人机影像。它包括跨越15个不同景观概念的653个斑块和1,450个随机参考斑块,旨在适用于广泛的物种。我们通过两个水生昆虫(襀翅目和毛翅目)的案例研究,使用两个卷积神经网络和一个视觉Transformer来展示这种方法。结果表明,基于概念的XAI有助于根据专家知识验证SDMs,同时发现产生新生态假说的新颖关联。Robust TCAV还提供了景观层面的信息,对政策制定和土地管理有用。代码和数据集公开可用。

英文摘要

Mapping the spatial distribution of species is essential for conservation policy and invasive species management. Species distribution models (SDMs) are the primary tools for this task, serving two purposes: achieving robust predictive performance while providing ecological insights into the driving factors of distribution. However, the increasing complexity of deep learning SDMs has made extracting these insights more challenging. To reconcile these objectives, we propose the first implementation of concept-based Explainable AI (XAI) for SDMs. We leverage the Robust TCAV (Testing with Concept Activation Vectors) methodology to quantify the influence of landscape concepts on model predictions. To enable this, we provide a new open-access landscape concept dataset derived from high-resolution multispectral and LiDAR drone imagery. It includes 653 patches across 15 distinct landscape concepts and 1,450 random reference patches, designed to suit a wide range of species. We demonstrate this approach through a case study of two aquatic insects, Plecoptera and Trichoptera, using two Convolutional Neural Networks and one Vision Transformer. Results show that concept-based XAI helps validate SDMs against expert knowledge while uncovering novel associations that generate new ecological hypotheses. Robust TCAV also provides landscape-level information, useful for policy-making and land management. Code and datasets are publicly available.

2512.02908 2026-06-19 q-bio.MN q-bio.QM q-bio.SC 版本更新 80%

Imperfect molecular detection can renormalize apparent kinetic rates in stochastic gene regulatory networks

不完美的分子检测可以重整化随机基因调控网络中的表观动力学速率

Iryna Zabaikina, Ramon Grima

专题命中 其他科学智能 :研究不完美分子检测对基因调控网络随机动力学的影响。

AI总结 研究不完美分子检测对基因调控网络随机动力学的影响,发现捕获效应在某些条件下可重整化动力学速率,为解释噪声单细胞测量提供系统基础。

Comments 28 pages, 6 figures. Changes include Table I, demonstrating accurate renormalization even for mean protein copy numbers of only a few tens of molecules, and Fig. 6, summarizing all models, reaction schemes, assumptions, rate rescalings, and validity regimes. The conclusion was expanded to discuss practical applications

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AI中文摘要

单细胞实验中的不完美分子检测引入了技术噪声,掩盖了基因调控网络的真实随机动力学。虽然分子捕获的二项模型提供了不完美检测的原理性描述,但迄今为止仅针对未明确考虑调控的简单基因表达模型进行了分析。在这里,我们将捕获的二项模型扩展到一般基因调控网络,以理解不完美捕获如何重塑观察到的分子计数的时间相关统计量。我们的结果揭示了捕获效应何时对应于一部分动力学速率的重整化,以及何时不能被吸收为有效速率,从而为解释有噪声的单细胞测量提供了系统基础。特别地,我们表明速率重整化取决于模型中调控细节的水平。对于基于启动子状态转换的隐式调控模型,只要基因产物合成不触发启动子状态变化(例如没有启动子近端暂停或暂停短暂),就会发生重整化。对于具有显式转录因子结合的模型,同样的条件成立,同时需要足够高的转录因子丰度,实际上每个细胞只需几十个分子。在这些情况下,技术噪声降低了合成基因产物的表观平均爆发大小,并加速了转录因子结合反应的表观速率。这种加速随着参与启动子转换的蛋白质种类和/或分子数量的增加而增强。这些效应对任意连接性的基因调控网络都成立,并且在时间依赖的动力学速率下仍然有效。

英文摘要

Imperfect molecular detection in single-cell experiments introduces technical noise that obscures the true stochastic dynamics of gene regulatory networks. While binomial models of molecular capture provide a principled description of imperfect detection, they have so far been analyzed only for simple gene-expression models that do not explicitly account for regulation. Here, we extend binomial models of capture to general gene regulatory networks to understand how imperfect capture reshapes the observed time-dependent statistics of molecular counts. Our results reveal when capture effects correspond to a renormalization of a subset of the kinetic rates and when they cannot be absorbed into effective rates, providing a systematic basis for interpreting noisy single-cell measurements. In particular, we show that rate renormalization depends on the level of regulatory detail in the model. For implicit regulatory models based on promoter state transitions, it arises whenever gene product synthesis does not trigger a promoter state change, as in the absence of promoter-proximal pausing or when pausing is short-lived. For models with explicit transcription factor binding, the same condition holds, together with sufficiently high transcription factor abundance, which in practice requires only a few tens of molecules per cell. In these cases, technical noise reduces the apparent mean burst size of synthesized gene products and accelerates the apparent rates of transcription factor binding reactions. This acceleration becomes stronger as the number of protein species and/or molecules involved in promoter switching increases. These effects hold for gene regulatory networks of arbitrary connectivity and remain valid under time-dependent kinetic rates.

2510.18589 2026-06-19 physics.bio-ph cond-mat.stat-mech q-bio.PE 版本更新 80%

Inheritance Entropy: A Model-Independent Method to Probe the Hereditary Structure of Cell Lineage Trees

继承熵:一种探测细胞谱系树遗传结构的模型无关方法

Alessandro Allegrezza, Riccardo Beschi, Domenico Caudo, Andrea Cavagna, Alessandro Corsi, Antonio Culla, Samantha Donsante, Giuseppe Giannicola, Irene Giardina, Giorgio Gosti, Tomas S. Grigera, Stefania Melillo, Biagio Palmisano, Leonardo Parisi, Lorena Postiglione, Mara Riminucci, Francesco Saverio Rotondi

专题命中 其他科学智能 :提出继承熵度量细胞谱系树遗传结构,属于生物物理

AI总结 针对骨髓基质细胞集落异质性,提出继承熵度量谱系树中失活细胞分布的分支遗传性,证明非遗传继承在细胞周期退出中起关键作用。

Comments 16 pages, 9 figures. Added results and updated references

Journal ref PRX Life 4, 023023 2026

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AI中文摘要

人骨髓基质细胞(BMSC)包括具有突破性治疗潜力的骨骼干细胞。然而,由于BMSC集落具有不同的效力,它们在体内的行为高度异质;这种不可预测性是骨骼再生疗法发展的最大障碍。集落水平的异质性引发了一个基本问题:一个集落作为集体单位如何可能表现得与另一个不同?如果细胞间变异只是一个不相关的随机过程,那么移植集落中的百万个细胞足以产生统计同质性,从而消除任何集落水平特征。一个可能的答案是,两个起始细胞之间的差异传递给它们的后代,并通过遗传机制集体持续存在。但非遗传继承在实验和理论层面仍然是一个难以捉摸的概念。在这里,我们证明BMSC克隆集落的谱系拓扑异质性由调节细胞周期退出的可遗传特征决定。这一结果的基石是定义了一个新的集落熵,它衡量失活细胞在增殖树不同分支间分布的遗传分支。我们在32个克隆集落中测量了熵,这些集落来自单细胞谱系追踪实验,并显示在绝大多数克隆中,该熵明显小于相应的非遗传谱系。这一结果表明,遗传表观遗传因素在决定骨髓基质细胞的周期退出中起主要作用。

英文摘要

Human bone marrow stromal cells (BMSC) include skeletal stem cells with ground-breaking therapeutic potential. However, BMSC colonies have very heterogeneous in vivo behaviour, due to their different potency; this unpredictability is the greatest hurdle to the development of skeletal regeneration therapies. Colony-level heterogeneity urges a fundamental question: how is it possible that one colony as a collective unit behaves differently from another one? If cell-to-cell variability were just an uncorrelated random process, a million cells in a transplant-bound colony would be enough to yield statistical homogeneity, hence washing out any colony-level traits. A possible answer is that the differences between two originating cells are transmitted to their progenies and collectively persist through an hereditary mechanism. But non-genetic inheritance remains an elusive notion, both at the experimental and at the theoretical level. Here, we prove that heterogeneity in the lineage topology of BMSC clonal colonies is determined by heritable traits that regulate cell-cycle exit. The cornerstone of this result is the definition of a novel entropy of the colony, which measures the hereditary ramifications in the distribution of inactive cells across different branches of the proliferation tree. We measure the entropy in 32 clonal colonies, obtained from single-cell lineage tracing experiments, and show that in the greatest majority of clones this entropy is decisively smaller than that of the corresponding non-hereditary lineage. This result indicates that hereditary epigenetic factors play a major role in determining cycle exit of bone marrow stromal cells.

3. 材料化学 3 篇

2602.15437 2026-06-19 cond-mat.mes-hall cond-mat.mtrl-sci physics.atm-clus physics.chem-ph 版本更新 80%

Isotope effect in the work function of lithium

锂功函数的同位素效应

Atef A. Sheekhoon, Abdelrahman O. Haridy, Vitaly V. Kresin

专题命中 材料化学 :测量锂功函数的同位素效应,涉及量子材料

AI总结 通过测量7Li和6Li纳米颗粒的光电离功函数随温度变化,发现显著同位素效应,且曲率大于电子气密度变化所致,揭示了锂中电子-离子自由度非平凡相互作用。

Journal ref Physical Review B 113, 235407 (2026)

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AI中文摘要

通过光束中纯孤立金属纳米颗粒的光电离,测量了7Li和6Li金属的功函数随温度的变化。这些数据揭示了这些功函数温度变化中的显著同位素效应。此外,对于两种同位素,发现这种温度变化的曲率明显大于可能仅归因于电子气密度变化的值。这些发现增强了锂作为量子材料的表征,其中电子和离子自由度之间的相互作用是非平凡的,并需要超越简单模型的微观理解。此外,观察到功函数曲线的斜率在低温极限下消失,正如基于热力学第三定律所预测的那样。

英文摘要

The work functions of 7Li and 6Li metals have been measured as a function of temperature, by using photoionization of pure isolated metal nanoparticles in a beam. These data reveal a marked isotope effect in the temperature variation of these work functions. Furthermore, for both isotopes the curvature of this temperature variation is found to be significantly larger than may be ascribed purely to a change in the electron gas density. These findings enhance the characterization of lithium as a quantum material in which the interplay between electronic and ionic degrees of freedom is nontrivial, and call for a microscopic understanding beyond simple models. Additionally, the slope of the work function curves was observed to vanish in the low temperature limit, as had been predicted on the basis of the Third Law of thermodynamics.

2602.09031 2026-06-19 physics.comp-ph cond-mat.mtrl-sci 版本更新 80%

A complete phase-field fracture model for brittle materials subjected to thermal shocks

热冲击下脆性材料的完整相场断裂模型

Bo Zeng, John E. Dolbow

专题命中 材料化学 :提出热冲击下脆性材料的相场断裂模型

AI总结 提出一个完整的相场断裂模型,用于热力耦合问题,独立指定材料属性、强度和断裂韧性,通过玻璃淬火、陶瓷红外辐射和快速功率脉冲等实验验证,模型能统一处理不同断裂场景,优于经典方法。

Comments 34 pages, 24 figures

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AI中文摘要

受到热冲击的脆性材料会经历强烈的温度梯度,进而产生足以引起断裂的机械应力。本文提出了一个用于热力耦合问题的完整相场断裂模型,其中块体材料属性、材料强度和断裂韧性可独立指定。该模型的能力在热力断裂的广泛场景中进行了评估,从大型预存裂纹的扩展到空间均匀应力状态下的裂纹成核。特别地,我们重新审视了玻璃板的受控淬火,并展示了模型如何捕捉在不同热载荷下实验观察到的裂纹模式。还研究了受红外辐射的陶瓷盘,模型再现了带缺口试样中的直裂纹和完整试样中的分叉裂纹。最后,研究了受快速功率脉冲作用的陶瓷颗粒,模型解释了从完整到断裂颗粒的实验转变以及材料强度的重要作用。结果表明,完整的相场模型统一了热冲击下不同断裂场景的处理,超越了经典方法,能够更可靠地预测极端环境中的脆性断裂。

英文摘要

Brittle materials subjected to thermal shocks experience strong temperature gradients that in turn give rise to mechanical stresses that can be large enough to induce fracture. This work presents a complete model for phase-field fracture for coupled thermo-mechanical problems, wherein the bulk material properties, the material strength, and the fracture toughness are specified independently. The capabilities of the model are assessed across a wide span of scenarios in thermo-mechanical fracture, from the propagation of large pre-existing cracks to crack nucleation under spatially uniform states of stress. In particular, we revisit the controlled quenching of glass plates, and demonstrate how the model captures experimentally observed crack patterns across a range of thermal loads. Ceramic disks subjected to infrared radiation are also examined, with the model reproducing both straight cracks in notched specimens and branching in intact specimens. Finally, ceramic pellets subjected to rapid power pulses are examined, with the model explaining experimental transitions from intact to fractured pellets and the important role of material strength. The results demonstrate that the complete phase-field model unifies the treatment of distinct fracture scenarios under thermal shock, surpassing classical approaches and enabling more reliable prediction of brittle fracture in extreme environments.

2601.06365 2026-06-19 cond-mat.mtrl-sci cond-mat.mes-hall 版本更新 80%

Dynamic nanoscale spatial heterogeneity in a perovskite to brownmillerite topotactic phase transformation

钙钛矿到褐锰矿拓扑相变中的动态纳米尺度空间异质性

Nicolò D'Anna, Erik S. Lamb, Robin Glefke, Daseul Ham, Ishmam Nihal, Su Yong Lee, Yayoi Takamura, Oleg Shpyrko

专题命中 材料化学 :原位XPCS研究钙钛矿相变动力学,属于材料科学。

AI总结 通过原位布拉格X射线光子相关光谱研究La0.7Sr0.3CoO3薄膜在恒定还原条件下的钙钛矿-褐锰矿拓扑相变,发现纳米尺度空间和动力学异质性,包括稳定的畴生长速度和加速的畴去钉扎动力学。

Comments 8 pages, 3 figures

Journal ref ACS Applied Materials & Interfaces 18 (2026) 32795

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AI中文摘要

相变在现代凝聚态物理及其应用中无处不在。在固体中,一级相变通常通过非平衡条件下的成核和生长发生。在恒定的外部条件下,例如恒定的退火温度和压力,成核和生长动力学通常被认为是空间和时间上独立的。在这里,原位布拉格X射线光子相关光谱(XPCS)揭示了在恒定还原条件下退火数小时的La$_{0.7}$Sr$_{0.3}$CoO$_3$薄膜中钙钛矿到褐锰矿拓扑相变的纳米尺度空间和动力学异质性。具体来说,与畴生长相关的时间尺度保持稳定,相应的畴壁速度为$v_d = 6 \pm 0.5 \times10^{-4}$~nm/s($2 \pm 0.2$~nm/h),而较慢的时间尺度与温度驱动的畴去钉扎相关,导致动力学加速,时间尺度遵循指数为-2.2$\pm$0.5的老化幂律。该实验表明,布拉格XPCS是研究结构相变中纳米尺度动力学的强大工具,能够原位提取与纳米畴运动相关的定量平均值。这些结果与相变器件的相工程相关,因为它们表明与畴和畴壁运动相关的纳米尺度动力学可以在相变开始后数小时内持续演化并加速,对电性能具有潜在影响。

英文摘要

Phase transitions are omnipresent in modern condensed matter physics and its applications. In solids, first-order phase transformations typically occur by nucleation and growth under non-equilibrium conditions. Under constant external conditions, $\textit{e.g.}$, constant annealing temperature and pressure, the nucleation and growth dynamics are often thought of as spatially and temporally independent. Here, $\textit{in-situ}$ Bragg X-ray photon correlation spectroscopy (XPCS) reveals nanoscale spatial and dynamical heterogeneity in the perovskite-to-brownmillerite topotactic phase transformation in La$_{0.7}$Sr$_{0.3}$CoO$_3$ thin films annealed under constant reducing conditions over a time span of multiple hours. Specifically, a timescale associated with domain growth remains stable, with a corresponding domain wall speed of $v_d = 6 \pm 0.5 \times10^{-4}$~nm/s ($2 \pm 0.2$~nm/h), while a slower timescale, associated with temperature-driven de-pinning of domains, leads to accelerating dynamics with timescales following an aging power law with exponent -2.2$\pm$0.5. This experiment demonstrates that Bragg XPCS is a powerful tool to study nanoscale dynamics in structural phase transformations, with the ability to extract quantitative average values related to nano-domain motion $\textit{in-situ}$. The results are relevant for phase engineering of phase-change devices, as they show that nanoscale dynamics, linked to domain and domain-wall motion, can continuously evolve and speed up with time, even hours after the initiation of the phase transformation, with potential repercussions on electrical performance.