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Strain-induced magnetic anisotropy and spin reorientation in monolayer FeCl(_2): a first-principles study 应变诱导磁各向异性和自旋取向在单层FeCl (_2):第一性原理研究
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2026-01-01 DOI: 10.1007/s40042-025-01549-6
Soumyajit Sarkar

Two-dimensional magnetic materials offer exciting possibilities for spintronic applications due to their tunable properties and reduced dimensionality. In this study, we employ density functional theory-based first-principles calculations to investigate the strain-dependent magnetic and electronic properties of monolayer FeCl(_2). The unstrained monolayer exhibits a robust ferromagnetic ground state with half-metallic character, and the Fe(^{2+}) ions remain in a high-spin configuration across the strain range of (-5%) to (+5%), indicating no spin-crossover transition. The Curie temperature, estimated via a mean-field Heisenberg model, is approximately 16 K. Notably, magnetocrystalline anisotropy energy calculations reveal a strain-induced reorientation of the magnetic easy axis from in-plane to out-of-plane at around 4% tensile strain, providing a controllable handle for spintronic device design. Phonon dispersion and formation energy analyses confirm the dynamical and thermodynamic stability of the monolayer. These results highlight the potential of FeCl(_2) as a stable, strain-tunable platform for 2D spintronic applications. Future studies involving substrate effects, chemical doping, or heterostructure engineering may further enhance magnetic ordering and broaden the material’s applicability in low-dimensional device architectures.

二维磁性材料由于其可调特性和降维特性,为自旋电子应用提供了令人兴奋的可能性。在本研究中,我们采用基于密度泛函理论的第一性原理计算来研究单层FeCl (_2)的应变相关磁性和电子特性。未应变的单分子膜表现出具有半金属性质的坚固铁磁基态,Fe (^{2+})离子在(-5%) ~ (+5%)应变范围内保持高自旋构型,表明没有自旋交叉转变。通过平均场海森堡模型估计,居里温度约为16k。值得注意的是,磁晶各向异性能量计算揭示了应变诱导的磁易轴在4左右从面内到面外的重定向% tensile strain, providing a controllable handle for spintronic device design. Phonon dispersion and formation energy analyses confirm the dynamical and thermodynamic stability of the monolayer. These results highlight the potential of FeCl(_2) as a stable, strain-tunable platform for 2D spintronic applications. Future studies involving substrate effects, chemical doping, or heterostructure engineering may further enhance magnetic ordering and broaden the material’s applicability in low-dimensional device architectures.
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引用次数: 0
Analyzing soliton wave structures and chaotic dynamics for the Sharma–Tasso–Olver–Burgers equation: theoretical analysis and simulations 分析沙玛-塔索-奥尔弗-伯格方程的孤子波结构和混沌动力学:理论分析和模拟
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2026-01-01 DOI: 10.1007/s40042-025-01544-x
Jan Muhammad, Usman Younas, Muhammad Naveed Rafiq, Muhammad Hamza Rafiq

Solitary wave propagation is vital structure in nonlinear science due to their stability and persistence. In this work, we explore the diverse soliton solutions and quasi-periodic structures for the Sharma–Tasso–Olver–Burgers equation. By applying the generalized Arnous method and the new modified generalized exponential rational function method, we obtain bright solitons, dark solitons, periodic waves, singular structures, and exponential-type localized solutions. The formation and propagation of these waves are captured through graphical illustration of 3D, 2D and density plots and validity of results confirmed. Additionally, we perturb the dynamical system corresponding to the studied equation and observe quasi-periodic behavior in the perturbed system using various chaos detection tools. These results have potential applications in fluid dynamics, plasma physics, nonlinear optics, and high-speed signal transmission.

孤立波传播具有稳定性和持续性,是非线性科学研究中的重要结构。在这项工作中,我们探讨了Sharma-Tasso-Olver-Burgers方程的各种孤子解和拟周期结构。应用广义Arnous方法和新的修正广义指数有理函数方法,得到了亮孤子、暗孤子、周期波、奇异结构和指数型局域解。通过三维、二维和密度图的图形说明捕捉了这些波的形成和传播,并证实了结果的有效性。此外,我们利用各种混沌检测工具对所研究方程对应的动力系统进行扰动,观察扰动后系统的准周期行为。这些结果在流体动力学、等离子体物理、非线性光学和高速信号传输等领域具有潜在的应用前景。
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引用次数: 0
Anomalous van Vleck paramagnetism induced by the spin–orbit coupling in Ba3CoSb2O9 Ba3CoSb2O9中自旋-轨道耦合诱导的反常van Vleck顺磁性
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-30 DOI: 10.1007/s40042-025-01556-7
Jong-Hyeok Choi, Choong-Jae Won, Woo-Suk Noh, Seung-Hwan Do, Jae-Hoon Park

We investigated magnetic moment behaviors of a frustrated antiferromagnet Ba3CoSb2O9 using the field-dependent full-multiplet CoO6 cluster model calculations with physical quantities determined from the Co L2,3-edge X-ray absorption spectroscopy (XAS) analysis. The XAS analysis shows that the Co 3d spin–orbit coupling is essential to determine the ground state, which becomes Kramer’s doublet states, the so-called Jeff = 1/2 states, split by the spin–orbit coupling from the conventional high spin S = 3/2 4T1 (t2g5eg2) states. The calculation yields a 2.17 μB ground state magnetic moment consistent with the reported ~ 1.93 μB extrapolated from the high field MH magnetization curve. Our field-dependent model calculations successfully well reproduce the field-dependent magnetization M(H) in the high field region (> 30 T). The spin–orbit coupling turns out to originate an anomalously large van Vleck paramagnetism well explaining the reported susceptibility.

我们利用场相关的全多元CoO6簇模型计算了受挫反铁磁体Ba3CoSb2O9的磁矩行为,并利用Co L2,3边x射线吸收光谱(XAS)分析确定了物理量。XAS分析表明,Co三维自旋-轨道耦合是确定基态的必要条件,基态由传统的高自旋S = 3/2 4T1 (t2g5eg2)态分裂成克莱默双重态,即Jeff = 1/2态。计算得到的基态磁矩为2.17 μB,与根据高场M-H磁化曲线外推得到的~ 1.93 μB一致。我们的场相关模型计算成功地再现了高场区域(> 30 T)的场相关磁化强度M(H)。自旋轨道耦合产生了异常大的范弗利克顺磁性,很好地解释了所报道的磁化率。
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引用次数: 0
Site-specific fluorophore labeling for single-molecule analysis: methods, applications, and future directions 用于单分子分析的位点特异性荧光标记:方法、应用和未来方向
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-24 DOI: 10.1007/s40042-025-01553-w
Byeong-gu Han, Tham Truong Phuong Tran, Byoung Choul Kim

Single-molecule analysis techniques, including single-molecule fluorescence resonance energy transfer (smFRET), super-resolution microscopy (SRM), and force spectroscopy, provide indispensable insights into molecular heterogeneity and transient dynamics. However, the quantitative power of these approaches is fundamentally limited by conventional stochastic labeling methods, which often yield heterogeneous stoichiometry, functional perturbation, and substantial spatial uncertainty due to linkage errors. To address these challenges, this review systematically examines state-of-the-art strategies for precise, site-specific fluorophore attachment. We categorize key approaches ranging from well-established chemical modifications (e.g., cysteine-maleimide) to advanced enzymatic tags (e.g., SNAP-tags, HaloTags) and genetic code expansion (GCE) coupled with bioorthogonal chemistry. Crucially, beyond a mere overview of methods, we highlight an integrative workflow that synergizes these labeling strategies with advanced computational modeling—such as structural prediction and molecular dynamics simulations—to enable rational experiment design and minimize linkage errors. We further discuss how these optimized protocols enhance labeling stoichiometry and probe photostability, thereby extending the spatiotemporal resolution of in-cell imaging. Finally, we conclude with emerging directions, focusing on orthogonal multi-site labeling schemes and next-generation fluorophores that promise high-fidelity molecular tracking under physiologically relevant conditions.

单分子分析技术,包括单分子荧光共振能量转移(smFRET),超分辨率显微镜(SRM)和力谱,为分子异质性和瞬态动力学提供了不可或缺的见解。然而,这些方法的定量能力从根本上受到传统随机标记方法的限制,这些方法通常会产生非均质化学计量学、功能扰动以及由于链接误差导致的大量空间不确定性。为了应对这些挑战,本综述系统地研究了精确的、特定位点的荧光团附着的最新策略。我们对关键方法进行了分类,从成熟的化学修饰(例如,半胱氨酸-马来酰亚胺)到先进的酶标记(例如,snaptags, HaloTags)和结合生物正交化学的遗传密码扩展(GCE)。至关重要的是,除了对方法的简单概述之外,我们还强调了将这些标记策略与先进的计算建模(如结构预测和分子动力学模拟)协同起来的综合工作流程,以实现合理的实验设计并最大限度地减少连接错误。我们进一步讨论了这些优化方案如何增强标记化学计量学和探针光稳定性,从而扩展细胞内成像的时空分辨率。最后,我们总结了新兴方向,重点是正交多位点标记方案和下一代荧光团,有望在生理相关条件下实现高保真的分子跟踪。
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引用次数: 0
Structural and magnetic characterization of nanocrystalline Fe₂CuAl Heusler alloy powders synthesized by mechanical alloying 机械合金化法制备纳米晶fe2cual Heusler合金粉末的结构和磁性表征
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-23 DOI: 10.1007/s40042-025-01542-z
Hanane Mechri, Hamza Azzaz, Fatiha Djaidi, Mohammed Azzaz

The Fe₂CuAl Heusler alloy is considered a valuable candidate for future magnetic technologies, including spintronics, sensing, and data storage, due to its adjustable magnetic characteristics. In this work, a mechanical alloying approach was employed to synthesize Fe₂CuAl powders, followed by comprehensive structural and magnetic characterization. XRD analysis confirmed the formation of a nanocrystalline Fe₂CuAl phase after 24 h of milling, accompanied by an increasing lattice parameter with milling duration, indicating solute diffusion. SEM revealed significant morphological evolution toward homogeneous and refined particles. Magnetic hysteresis measurements demonstrated a peak in coercivity at 8 h (102.4 Oe), attributed to microstructural refinement, while the saturation magnetization remained within a narrow range (95.9–104.9 emu/g). A declining trend in the Mr/Ms ratio beyond 24 h suggests an increase in structural disorder. Overall, the synthesized Fe₂CuAl alloy exhibits a stable A2-type disordered structure, demonstrates the effectiveness of mechanical alloying to fine-tune microstructure and magnetic behavior in Fe-based Heusler systems, offering insights into their optimization for magnetic device applications.

fe2cual Heusler合金被认为是未来磁性技术的有价值的候选者,包括自旋电子学,传感和数据存储,由于其可调节的磁性特性。本文采用机械合金化方法合成了Fe₂CuAl粉末,并对其进行了全面的结构和磁性表征。XRD分析证实,磨矿24 h后形成了纳米晶Fe₂CuAl相,且晶格参数随磨矿时间的增加而增加,表明溶质扩散。扫描电镜显示明显的形态演化向均匀和细化的颗粒。磁滞测量表明,由于微观结构的细化,矫顽力在8 h (102.4 Oe)时达到峰值,而饱和磁化强度保持在一个狭窄的范围内(95.9-104.9 emu/g)。Mr/Ms比值在24 h后呈下降趋势,表明结构紊乱增加。总体而言,合成的Fe₂CuAl合金表现出稳定的a2型无序结构,证明了机械合金化对Fe基Heusler体系的微观结构和磁性行为的微调效果,为其在磁性器件应用中的优化提供了见解。
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引用次数: 0
Accelerator science in Korea: current challenges and future opportunities 韩国的加速器科学:当前的挑战和未来的机遇
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-17 DOI: 10.1007/s40042-025-01546-9
Seong-Hee Park, Hyyong Suk, Moses Chung

Accelerators that generate charged particle beams and boost them to the required energies have become an integral part of our daily life in various domains, ranging from materials processing and testing, medical diagnostics and therapy, and large-scale scientific discovery. This review traces the historical development of Korea’s accelerator technology, summarizes the status of domestic large-scale accelerator facilities, and outlines strategic directions for next-generation infrastructures and applications. We highlight the current challenges and future opportunities across both discovery sciences and applied sectors, including global trends and Korea’s position in the international landscape.

产生带电粒子束并将其提升到所需能量的加速器已经成为我们日常生活中各个领域不可或缺的一部分,从材料加工和测试,医疗诊断和治疗,到大规模的科学发现。本文回顾了韩国加速器技术的历史发展,总结了国内大型加速器设施的现状,并概述了下一代基础设施和应用的战略方向。我们重点介绍了发现科学和应用领域当前的挑战和未来的机遇,包括全球趋势和韩国在国际格局中的地位。
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引用次数: 0
Optical modeling of a GaAs-defect 1D porous silicon photonic crystal for high-sensitivity γ-ray detection 用于高灵敏度γ射线探测的gaas缺陷一维多孔硅光子晶体光学建模
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-15 DOI: 10.1007/s40042-025-01539-8
Shaimaa El-Shemy, Arafa H. Aly, Emad Nady, Gaurav Malik, Heedae Kim

Radiation sensors play a crucial role in diverse fields such as medical diagnostics, environmental monitoring, and nuclear safety. However, many conventional sensors face challenges related to limited sensitivity and operational stability. In this work, we theoretically propose a high-performance γ-ray radiation sensor based on a one-dimensional porous silicon photonic crystal (1D PhC) incorporating a gallium arsenide (GaAs) defect layer and porous silicon layers infiltrated with chalcogenide glass compositions (Se70S30–xSbx). The sensing principle is governed by monitoring the shift of the defect mode resonance within the photonic band gap as a function of γ-ray dose (0–500 kGy). Variations in the refractive index of the irradiated chalcogenide glasses were modeled using Bruggeman’s effective medium approximation and incorporated into transfer matrix method (TMM) simulations. The proposed design combines structural simplicity, cost efficiency, and superior sensing metrics, underscoring its strong potential for practical deployment in nuclear radiation detection, medical imaging, and industrial monitoring applications.

辐射传感器在医疗诊断、环境监测、核安全等多个领域发挥着至关重要的作用。然而,许多传统传感器面临着与有限的灵敏度和操作稳定性相关的挑战。在这项工作中,我们从理论上提出了一种基于一维多孔硅光子晶体(1D PhC)的高性能γ射线辐射传感器,该晶体包含砷化镓(GaAs)缺陷层和渗透有硫系玻璃成分(Se70S30-xSbx)的多孔硅层。传感原理是通过监测光子带隙内缺陷模共振的位移作为γ射线剂量(0-500 kGy)的函数来控制的。采用Bruggeman有效介质近似法模拟辐照后硫系玻璃折射率的变化,并将其纳入传递矩阵法(TMM)模拟。提出的设计结合了结构简单、成本效率和优越的传感指标,强调了其在核辐射检测、医学成像和工业监测应用中实际部署的强大潜力。
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引用次数: 0
Field-resilient superconducting coplanar waveguide resonators made of Nb, NbTi, and NbTiN 由铌、NbTi和NbTiN制成的场弹性超导共面波导谐振器
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-10 DOI: 10.1007/s40042-025-01536-x
Bongkeon Kim, Chang Geun Yu, Priyanath Mal, Yong-Joo Doh

Superconducting coplanar waveguide (SCPW) resonators with high internal quality factors (Qi) are essential for quantum information applications, but suffer severe Qi degradation under magnetic fields due to quasiparticle generation and vortex-induced losses. We fabricated and characterized Nb, NbTi, and NbTiN SCPW resonators with varying film thicknesses under different temperatures and in-plane magnetic fields (B||). Temperature-dependent transmission measurements agree well with Mattis–Bardeen theory, revealing kinetic inductance parameters. Comparative analysis shows that 45-nm-thick NbTi resonators maintain Qi = 1.01 × 104 at B|| = 0.4 T, satisfying the dual requirements of high Qi and strong field resilience. Owing to its moderate kinetic inductance and compatibility with conventional photolithography, NbTi emerges as a practical material platform for field-resilient SCPW resonators and hybrid quantum circuits operating in magnetic environments.

具有高内质因子(Qi)的超导共面波导(SCPW)谐振器在量子信息应用中是必不可少的,但由于准粒子的产生和涡致损耗,在磁场下会导致严重的Qi退化。我们制作并表征了在不同温度和平面磁场(B||)下具有不同薄膜厚度的Nb、NbTi和NbTiN SCPW谐振器。温度相关的透射测量与Mattis-Bardeen理论一致,揭示了动力学电感参数。对比分析表明,45 nm厚NbTi谐振腔在B|| = 0.4 T时保持Qi = 1.01 × 104,满足高Qi和强场弹性的双重要求。由于其适度的动态电感和与传统光刻技术的兼容性,NbTi成为在磁环境下工作的场弹性SCPW谐振器和混合量子电路的实用材料平台。
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引用次数: 0
Performance of underlap GAA-FET using GaAs substrate and SiO2 gate oxide GaAs衬底和SiO2栅极氧化物衬底下搭接GAA-FET的性能
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-03 DOI: 10.1007/s40042-025-01538-9
P. Harikrishnan, B. Mohan, K. Rajesh, R. Santhana Krishnan

This work investigates a Gate-All-Around Field-Effect Transistor (GAA-FET) architecture employing an underlap configuration, with Gallium Arsenide (GaAs) as the substrate material and silicon dioxide (SiO2) as the gate dielectric. The device is designed at the 22 nm technology node, where the introduction of underlap regions—intentional spacing between the gate and source/drain contacts offers refined control over short-channel behavior and electrostatic integrity. The proposed GaAs underlap GAA-FET structure introduces an optimized 2.5 nm underlap region validated through calibrated TCAD modeling, achieving improved short-channel control and switching efficiency compared to prior works. GaAs is selected for its high electron mobility, which enhances channel transport characteristics compared to conventional silicon-based implementations. Device modeling and electrical analysis are performed using Technology Computer-Aided Design (TCAD) tools to evaluate the impact of the underlap geometry on key performance indicators. Critical parameters, including Vth, drive current, leakage current, ON/OFF current ratio, subthreshold slope, and Drain-Induced Barrier Lowering (DIBL), are systematically analyzed. The role of fringing fields and parasitic capacitances induced by the underlap layout is also examined for their influence on switching behavior and device scaling. Simulation outcomes confirm that the proposed GaAs-based underlap GAA-FET structure offers improved electrostatic control, reduced leakage, and enhanced switching performance, positioning it as a strong candidate for future ultra-scaled, energy-efficient semiconductor technologies.

本研究研究了一种栅极全能场效应晶体管(GAA-FET)结构,采用下包结构,砷化镓(GaAs)作为衬底材料,二氧化硅(SiO2)作为栅极介电介质。该器件设计在22纳米技术节点,其中引入了underlap区域-栅极和源/漏极触点之间有意的间距,提供了对短通道行为和静电完整性的精细控制。提出的GaAs underlap GAA-FET结构引入了优化的2.5 nm underlap区域,通过校准的TCAD建模验证,与先前的工作相比,实现了改进的短通道控制和开关效率。选择GaAs是因为其高电子迁移率,与传统的硅基实现相比,它增强了通道传输特性。使用技术计算机辅助设计(TCAD)工具进行器件建模和电气分析,以评估覆盖几何形状对关键性能指标的影响。系统分析了Vth、驱动电流、漏电流、ON/OFF电流比、亚阈值斜率和漏极诱导势垒降低(DIBL)等关键参数。本文还研究了由搭接布局引起的边缘场和寄生电容对开关行为和器件缩放的影响。仿真结果证实,所提出的基于gaas的underlap GAA-FET结构提供了更好的静电控制,减少泄漏和增强的开关性能,使其成为未来超大规模,节能半导体技术的有力候选。
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引用次数: 0
Surface chemical state evolution of hydrogen-exposed amorphous IGZO thin films investigated by synchrotron XPS 同步XPS研究氢暴露非晶IGZO薄膜的表面化学态演变
IF 0.9 4区 物理与天体物理 Q3 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-02 DOI: 10.1007/s40042-025-01537-w
Se Jun Kang, Jaeyoon Baik, Hyun-Joon Shin

Hydrogen exposure plays a critical role in determining the surface chemistry and electrical behavior of amorphous In–Ga–Zn–O (a-IGZO) thin films, which are widely used as transparent channel materials in oxide-based electronics. In this study, we performed an in situ synchrotron-based X-ray photoelectron spectroscopy (XPS) investigation on hydrogen-exposed a-IGZO surfaces to elucidate the competing effects of hydrogen incorporation on oxygen vacancies (VO) and metallic states. Clean a-IGZO thin films were sequentially exposed to atomic hydrogen at coverages of 3.6 × 104 L and 1.1 × 105 L. As the hydrogen exposure increased, the O 1s spectra revealed a systematic reduction of both the oxygen vacancy (OV) and metal–oxide (OM) components, while the valence band spectra exhibited a simultaneous decrease in deep subgap states (DSS) and an enhancement of metallic features near the Fermi level. The In 3d spectra further confirmed the growth of metallic indium (In0) species, indicating that hydrogen not only passivates oxygen vacancies, but also induces reduction of indium ions at the surface. These findings suggest that hydrogen incorporation leads to two competing processes—vacancy filling and metal-ion reduction—that together influence the electronic transport behavior of a-IGZO thin films under hydrogen-rich environments. The results provide new insight into the role of hydrogen in tuning surface electronic structures of oxide semiconductors, which is crucial for reliable device performance and long-term stability.

非晶in - ga - zn - o (a- igzo)薄膜是广泛应用于氧化物基电子产品的透明通道材料,氢暴露对其表面化学和电学行为起着至关重要的作用。在这项研究中,我们对氢暴露的a-IGZO表面进行了基于原位同步加速器的x射线光电子能谱(XPS)研究,以阐明氢加入对氧空位(VO)和金属态的竞争影响。将清洁的a- igzo薄膜依次暴露在3.6 × 104 L和1.1 × 105 L的原子氢下,随着氢暴露量的增加,O - 1s光谱显示氧空位(OV)和金属氧化物(OM)组分都有系统的减少,而价带光谱显示深亚隙态(DSS)同时减少,金属特征在费米能级附近增强。In三维光谱进一步证实了金属铟(In0)的生长,表明氢不仅钝化了氧空位,而且还诱导了表面铟离子的还原。这些发现表明,氢的掺入导致两个相互竞争的过程-空位填充和金属离子还原-共同影响a-IGZO薄膜在富氢环境下的电子输运行为。这些结果为氢在调整氧化物半导体表面电子结构中的作用提供了新的见解,这对于可靠的器件性能和长期稳定性至关重要。
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引用次数: 0
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Journal of the Korean Physical Society
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