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High-Temperature Superconductivity in Li-Removed Icosahedral B13C2 脱锂二十面体B13C2的高温超导性
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500534
Xiaojun Wang, Feng Chen, Jingyu Hou, Xiao-Ji Weng, Guochun Yang, Xiang-Feng Zhou

The B12 icosahedron serves as the fundamental building block in boron-rich compounds, where the combination of strong multi-center covalent bonding and low atomic mass favors high-frequency phonons and robust electron-phonon coupling, rendering them as promising candidates for high-temperature superconductivity. However, these materials are typically insulating due to the electron-counting rule. Here, we propose a viable strategy to achieve superconductivity in LiB13C2 by degassing Li and leading to the formation of icosahedron-based B13C2 superconductor. First-principles calculations demonstrate that the removal of Li alters density of states at the Fermi level (NEF${N_{{E_F}}}$) while retains its 3D covalent framework. Strikingly, after the complete removal of Li, the resulting B13C2 is predicted to be an anisotropic single-gap superconductor with a critical temperature (Tc) of 53 K, primarily driven by strong coupling between B12 icosahedral vibrational modes and conduction electrons. This work illustrates a potential route toward achieving high-temperature superconductivity in icosahedron-based boron-rich frameworks.

B12二十面体是富硼化合物的基本组成部分,其中强多中心共价键和低原子质量的结合有利于高频声子和强大的电子-声子耦合,使它们成为高温超导的有希望的候选者。然而,由于电子计数规则,这些材料通常是绝缘的。在这里,我们提出了一种可行的策略,通过脱气Li并导致形成基于二十面体的B13C2超导体来实现LiB13C2的超导性。第一性原理计算表明,Li的移除改变了费米能级(N E F ${N_{E_F}}}$)的态密度,同时保留了其三维共价框架。引人注目的是,在完全除去Li后,预测得到的B13C2是一个各向异性的单间隙超导体,临界温度(Tc)为53 K,主要由B12二十面体振动模式和传导电子之间的强耦合驱动。这项工作说明了在基于二十面体的富硼框架中实现高温超导性的潜在途径。
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引用次数: 0
Strong Out-of-Plane Nonlinear Optical Response in Janus Fluorinated Graphane 双面氟化石墨烯的强面外非线性光学响应
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500551
Yue Ma, Shi Qiu, Hongsheng Liu, Zhongyan Wei, Juan Hou, Junfeng Gao

The susceptibility of second-harmonic generation (SHG) is highly dependent on the symmetry of the material. Constructing a Janus structure by surface modification can break out-of-plane mirror symmetry, leading to asymmetric charge distribution and the generation of a built-in electric field. This study systematically investigates the electronic properties and nonlinear optical responses of Janus derivative of graphane, by one side, fluorinating graphane. Due to the vertical built-in electric field, the out-of-plane SHG response is approximately three times that of the in-plane response, reaching around 60 pm/V. Through the intensity polar plots of the Janus monolayer under different incident lights, the anisotropic response of SHG is further Analyses. This research provides theoretical guidance for further experimental exploration of Janus fluorinated graphane and lays a foundation for its application in nonlinear optical devices.

二次谐波产生(SHG)的磁化率高度依赖于材料的对称性。通过表面修饰构建Janus结构可以打破面外镜像对称,导致电荷分布不对称并产生内置电场。本研究系统地研究了石墨烯Janus衍生物的电子性质和非线性光学响应,其中一侧是氟化石墨烯。由于垂直的内置电场,面外SHG响应大约是面内响应的三倍,达到60 pm/V左右。通过不同入射光下Janus单层的强度极坐标图,进一步分析了SHG的各向异性响应。本研究为Janus氟化石墨烯的进一步实验探索提供了理论指导,并为其在非线性光学器件中的应用奠定了基础。
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引用次数: 0
Issue Information: Ann. Phys. 1/2026 发布信息:Ann。理论物理的1/2026
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.70119
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引用次数: 0
High-Temperature Superconductivity in H6SX and H9S2X at Mild Pressure H6SX和H9S2X在温和压力下的高温超导性
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500535
Qian Yang, Zihao Huo, Guiyan Dong, Wenxuan Chen, Jialiang Cai, Fubo Tian, Defang Duan

The high critical temperature (high-Tc) hydride superconductor H3S has attracted great interest in high-pressure superconductivity research. Finding a strategy to reduce its stabilization pressure while maintaining its high Tc is of great importance for hydrogen-based superconductor studies. In this work, we performed high-throughput calculations for Fd3¯m${Fd}{overline{3}}{m}$-H6SX, P3m1-H9S2X and P3¯m1${P}{overline{3}}{m1}$-H9S2X at chosen pressures, where X corresponds to elements from groups IIIA to VIIA. Our results reveal that the difference in covalent radius between S and X atoms is a critical factor influencing the dynamically stable pressure and superconductivity of H3S. The larger the covalent radius of X relative to S, the lower the dynamically stable pressure required for these hydrides, while still maintaining excellent superconductivity. Based on our analysis, we find that H9S2In, H9S2Sn, H9S2Te, and H6SIn remain dynamically stable at 20 GPa, with Tc of 54, 72, 5, and 54 K, respectively. Our study proposes a novel strategy of introducing elements with large covalent radii into cubic H3S to obtain high-Tc superconductors at mild pressure.

高临界温度(high- tc)氢化物超导体H3S已成为高压超导研究的热点。寻找一种既能降低其稳定压力又能保持其高Tc的策略对氢基超导体的研究具有重要意义。在这项工作中,我们对fd_3¯m ${Fd}{overline{3}}{m}$ -H6SX进行了高通量计算,P3m1-H9S2X和p3¯m1 ${P}{overline{3}}{m1}$ -H9S2X在选定压力下,其中X对应从IIIA到VIIA族的元素。结果表明,S原子和X原子之间的共价半径差异是影响H3S动态稳定压力和超导性的关键因素。X相对于S的共价半径越大,这些氢化物所需的动态稳定压力越低,同时仍能保持优异的超导性。根据我们的分析,我们发现H9S2In, H9S2Sn, H9S2Te和H6SIn在20gpa下保持动态稳定,Tc分别为54,72,5和54 K。我们的研究提出了一种新的策略,即在立方H3S中引入具有大共价半径的元素,从而在温和的压力下获得高tc超导体。
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引用次数: 0
The Quest for High-Temperature Superconductivity: Experimental Advances in Ternary Hydrides 高温超导的探索:三元氢化物的实验进展
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500476
Mingyu Zhang, Jianning Guo, Yulong Wang, Su Chen, Xinyue Wu, Jia Wei, Hai-Jun Wang, Xiaoli Huang

The quest for high-temperature superconductivity has recently been revolutionized by high-pressure hydrides, such as H3S and LaH10, however, their practical potential is limited by the extreme stabilization pressures. Ternary hydrides have emerged as a promising avenue to mitigate this pressure constraint and further enhance their superconducting properties. The increased compositional complexity in ternary ones offers greater structural versatility and tunability, leading to successful syntheses of compounds like La–Ce–H system and Lu–Y–H system at significantly lower pressures. This review comprehensively surveys the experimental advances in ternary hydride superconductors, highlighting recent discoveries across different structural families. Nevertheless, research in this domain faces substantial challenges, including synthetic inhomogeneity, complex phase diagrams, and difficulties in precise structural determination of hydrogen sublattices. This review also outlines future research trajectories, high pressure, conventional superconductivity, electron-phonon coupling, superconductor, ternary hydridesaimed at achieving high-temperature superconductivity under more practical conditions.

最近,高压氢化物(如H3S和LaH10)彻底改变了对高温超导性的追求,然而,它们的实际应用潜力受到极端稳定压力的限制。三元氢化物已成为缓解这种压力限制并进一步增强其超导性能的有希望的途径。三元化合物中增加的组成复杂性提供了更大的结构通用性和可调性,导致在较低的压力下成功合成了La-Ce-H体系和Lu-Y-H体系等化合物。本文综述了三元氢化物超导体的实验进展,重点介绍了不同结构家族的最新发现。然而,该领域的研究面临着巨大的挑战,包括合成的不均匀性,复杂的相图,以及精确确定氢亚晶格结构的困难。本文还概述了未来的研究轨迹、高压、常规超导、电子-声子耦合、超导体、三元氢化物等,以期在更实际的条件下实现高温超导。
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引用次数: 0
Quantum Spin Liquids Stabilized by Disorder in Non-Kramers Pyrochlores 非克雷默氏焦绿石中无序稳定的量子自旋液体
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500552
Marcus V. Marinho, Eric C. Andrade

We investigate the emergence of quantum spin liquid phases in pyrochlore oxides with non-Kramers ions, in which structural randomness effectively acts as a transverse field, introducing quantum fluctuations on top of the spin ice manifold. This is contrary to the naive expectation that disorder favors phases with short-range entanglement by adjusting the spins with their local environment. We study a minimal model for a disordered quantum spin ice, the transverse-field Ising model, using a real-space formulation of the gauge mean-field theory. This approach allows the inclusion of non-perturbative disorder effects exactly, and thus to assess the stability of the spin-liquid phase with respect to the disorder. The analysis shows that the quantum spin ice remains remarkably stable with respect to disorder up to the transition to the polarized phase at high fields, indicating that it can occur in real materials. A Griffiths region of enhanced disorder-induced fluctuations is restricted to the immediate vicinity of this transition due to the peculiar nature of the low-energy excitations of the problem. For most of the phase diagram, an average description of the disorder captures the physical behavior well, indicating that the inhomogeneous quantum spin ice behaves closely to its homogeneous counterpart.

我们研究了非克雷默离子的焦绿氧化物中量子自旋液相的出现,其中结构随机性有效地充当横向场,在自旋冰流形顶部引入量子涨落。这与天真的期望相反,即通过调整自旋与局部环境的关系,无序有利于具有短程纠缠的相。利用规范平均场理论的实空间表述,研究了无序量子自旋冰的最小模型——横场Ising模型。这种方法允许精确地包含非微扰无序效应,从而评估自旋液相相对于无序的稳定性。分析表明,在高场下,量子自旋冰在向极化相过渡之前,相对于无序保持了显著的稳定性,这表明它可以在实际材料中发生。由于问题的低能量激发的特殊性质,增强无序诱导涨落的Griffiths区域被限制在这个跃迁的直接附近。对于相图的大部分,无序的平均描述很好地捕获了物理行为,表明非均匀量子自旋冰的行为与其均匀对应物非常接近。
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引用次数: 0
Possible Vulnerability of Bell-Clauser-Horne-Shimony-Holt Tests Used for Quantum Certification 用于量子认证的bell - clauser - horn - shimony - holt测试可能存在的漏洞
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1002/andp.202500437
F. De Zela

A hidden variables (HVs) model is reported, which reproduces quantum predictions for Bell-Clauser-Horne-Shimony-Holt (Bell-CHSH) tests. The existence of such a model poses some limitations to quantum certifications that rely on Bell-CHSH inequality violations. The reported model does not prove wrong Bell's theorem. The latter assumes the factorability of the probability density pAB, which rules the stochastic behavior of the HVs. The reported HVs model is based on an extended form of pAB, which is suggested by Lebesgue's decomposition theorem for bounded functions. The considered pAB complies with locality and realism, and also with measurement independence, parameter independence and outcome independence.

报道了一个隐变量(HVs)模型,该模型再现了bell - clauser - horn - shimoni - holt (Bell-CHSH)测试的量子预测。这种模型的存在对依赖于违反Bell-CHSH不等式的量子认证提出了一些限制。报告的模型并没有证明错误的贝尔定理。后者假设概率密度pAB的可因子性,它支配着HVs的随机行为。本文提出的HVs模型是基于有界函数的Lebesgue分解定理提出的pAB的一种扩展形式。所考虑的pAB既符合局部性和现实性,又具有测量独立性、参数独立性和结果独立性。
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引用次数: 0
Quantum Monte Carlo Simulation of Bipolaron Superconductivity in Extended Hubbard–Holstein models on Face-Centered-Cubic and Body-Centered-Cubic Lattices 面心立方晶格和体心立方晶格扩展hubard - holstein模型双极化子超导的量子蒙特卡罗模拟
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-14 DOI: 10.1002/andp.202500343
Ganiyu D. Adebanjo, James P. Hague, Pavel E. Kornilovitch

We investigate superlight pairing of bipolarons driven by electron-phonon interactions (EPIs) in face-center-cubic (FCC) and body-center-cubic (BCC) lattices using a continuous-time path-integral quantum Monte Carlo (QMC) algorithm. The EPIs are of the Holstein and extended Holstein types, and a Hubbard interaction is also included. Effects of adiabaticity are calculated. The number of phonons associated with the bipolaron, inverse mass, and radius are calculated and used to construct a phase diagram for bipolaron pairing (identifying the regions of pairing into intersite bipolarons and onsite bipolarons). From the inverse mass we determine that for the extended interaction, there is a region of light pairing associated with intersite bipolarons formed in both BCC and FCC lattices. Intersite bipolarons in the extended model at intermediate phonon frequency and large Coulomb repulsion become superlight due to first order hopping effects. We estimate the transition temperature, determining that intersite bipolarons are associated with regions of high transition temperatures.

我们使用连续时间路径积分量子蒙特卡罗(QMC)算法研究了面中心立方(FCC)和体中心立方(BCC)晶格中由电子-声子相互作用(EPIs)驱动的双极化子的超光配对。epi是荷尔斯坦和扩展荷尔斯坦类型,也包括哈伯德交互作用。计算了绝热的影响。计算了与双极化子、反质量和半径相关的声子数,并用于构建双极化子配对的相图(确定配对区域为场间双极化子和场内双极化子)。从反质量我们确定,对于扩展相互作用,在BCC和FCC晶格中都形成了与场间双极化子相关的光配对区域。扩展模型中介子频率和大库仑斥力下的场间双极化子由于一阶跳变效应而变成超轻。我们估计了转变温度,确定了场间双极化子与高转变温度区域有关。
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引用次数: 0
Topological Phases Driven by Anisotropic Four-Spin Interactions in 1D Spin-1/2 XX Chains 一维自旋1/2 XX链中各向异性四自旋相互作用驱动的拓扑相
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-12 DOI: 10.1002/andp.202500435
Saeed Mahdavifar, Fatemeh Khastehdel Fumani

In this study, we investigate the emergence of non-trivial topological phases in a 1D spin-1/2 XX model induced by anisotropic four-spin interactions. By employing the fermionization technique, we precisely diagonalize the system's Hamiltonian and analytically identify three critical lines. Subsequently, we calculate the energy gap, fidelity susceptibility, cluster local order parameters, winding number, and entanglement spectrum. Our findings identify three crucial boundaries that divide five gapped phases, each characterized by the coexistence of symmetry-protected topological order and spontaneous symmetry breaking. Analyzing the winding number as a topological invariant allows us to distinguish these gapped phases as distinct non-trivial topological phases, characterized by integer values of ν=±3,±1$nu = pm 3, pm 1$. Moreover, we observe topological phase transitions at quantum critical points, where the winding number changes are associated with the closing and reopening of the energy gap. Furthermore, we demonstrate that for a given winding number ν$nu$, the degeneracy of the lowest eigenvalue in the entanglement spectrum is generally 2|ν|$2|nu |$. This work provides novel insights into the role of anisotropic four-spin interactions in driving topological phenomena in low-dimensional quantum systems, offering a deeper understanding of the interplay between topology and quantum fluctuations.

在本研究中,我们研究了由各向异性四自旋相互作用诱导的1D自旋-1/2 XX模型中非平凡拓扑相的出现。利用费米化技术,我们精确地对角化了系统的哈密顿量,并解析地确定了三条临界线。随后,我们计算了能隙、保真度磁化率、团簇局部序参数、圈数和纠缠谱。我们的研究结果确定了划分五个间隙相的三个关键边界,每个边界都以对称保护拓扑秩序和自发对称性破缺共存为特征。将圈数作为拓扑不变量进行分析,可以将这些间隙相区分为不同的非平凡拓扑相,其特征值为ν =±3,±1$ nu = pm 3, pm 1$。此外,我们观察到量子临界点的拓扑相变,其中圈数的变化与能隙的关闭和重新打开有关。进一步证明了对于给定的圈数ν $nu$,纠缠谱中最低特征值的简并度一般为2| ν |$ 2|nu |$。这项工作为各向异性四自旋相互作用在驱动低维量子系统拓扑现象中的作用提供了新的见解,为拓扑与量子涨落之间的相互作用提供了更深入的理解。
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引用次数: 0
Amortized Clustering Assistant Classification of Anomalous Hybrid Floquet Modes in a Periodically Driven Non-Hermitian Lattice 周期驱动非厄米格中异常杂化Floquet模式的平摊聚类辅助分类
IF 2.5 4区 物理与天体物理 Q2 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-12 DOI: 10.1002/andp.202500348
Yifei Xia, Xiumei Wang, Yali Li, Xingping Zhou

The interplay between Floquet periodically driving and non-Hermiticity could bring about intriguing novel phenomena with anomalous Floquet topological phases of a finite-size, tight-binding lattice model. How to efficiently investigate on quasi-energy and eigenstate distribution of a non-Hermitian Floquet system with complicated driving protocol remains a challenging task. In this work, we define a somewhat complex driving protocol for a bipartite lattice system for the investigation. Thereafter, we introduce unsupervised learning method in order to explore distribution features of system eigenfunctions under different magnitude of system energy gain/loss. An amortized clustering strategy is adopted to perform state classification. We further introduce an algorithm-selection mechanism that adapts to varying gain/loss strengths by choosing the most suitable clustering model based on unsupervised indices and task-oriented separability. Proper employment of the selector enables us to reveal the categories of eigenstate distribution from abundant possible wave function distribution in two-dimension lattice in another efficient way. In addition, our work provides a feasible methodology via machine Amortized Clustering, Periodically Driven non-Hermitian Lattice, nomalous Hybrid Floquet Modeslearning method to assist in classification of Floquet modes.

Floquet周期性驱动和非厄米性之间的相互作用可能带来有限尺寸紧密结合晶格模型的异常Floquet拓扑相的有趣新现象。如何有效地研究具有复杂驱动协议的非厄米Floquet系统的准能量和本态分布一直是一个具有挑战性的课题。在这项工作中,我们定义了一个比较复杂的驱动协议为二部格系统的研究。在此基础上,引入无监督学习方法,探索不同系统能量增益/损失量级下系统特征函数的分布特征。采用平摊聚类策略进行状态分类。我们进一步引入了一种算法选择机制,该机制通过基于无监督指标和面向任务的可分性选择最合适的聚类模型来适应不同的增益/损失强度。选择器的适当使用使我们能够以另一种有效的方式从二维晶格中丰富的可能波函数分布中揭示本征态分布的种类。此外,我们的工作提供了一种可行的方法,通过机器平摊聚类,周期驱动非厄米格,正则混合Floquet模式学习方法来辅助Floquet模式的分类。
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引用次数: 0
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Annalen der Physik
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