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Hexagonal B–C–N composite consisting of h -BN and graphite separated by B–C nanolayer 六方B-C - n复合材料由B-C纳米层分离的h -BN和石墨组成
1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-12-18 DOI: 10.1063/5.0302494
Baoyin Xu, Xiaohong Yuan, Bingtao Feng, Yifeng Jiang, Yaqi She, Zhanhui Ding, Yue Pan, Shitao Liu, Kuo Hu, Zhaodong Liu, Quanjun Li, Bingbing Liu, Hu Tang
Graphite and hexagonal boron nitride (h-BN), despite their structural similarity, exhibit opposing electronic properties, namely, metallic conductivity and wide-bandgap insulation, respectively. In recent years, graphene-h-BN heterostructures have attracted significant research interest, with the resulting hybrid B–C–N atomic-layer systems exhibiting distinctive electronic properties. Notably, interface effects play a decisive role in governing the performance of these heterostructures. Nevertheless, owing to the lack of high-quality composites, the interfacial structure in B–C–N materials and the correlation with critical properties such as charge transport and band structure modulation are not fully clear. Here, we report the direct synthesis of a millimeter-sized hexagonal B–C–N composite via a solvent method under high-pressure and high-temperature conditions. Structural characterization reveals that the synthesized B–C–N composite contains isolated graphite and h-BN. Compared with pure h-BN, the B–C–N composite has a narrower bandgap and shows a pronounced photoelectric response in the visible light region. More interestingly, we find a graphite-like B–C compound with a thickness of about 30 nm at the graphite–h-BN interface, which forms Schottky junctions with graphite, thus realizing rectification properties. Our findings provide a method for synthesizing high-quality B–C–N composites and offer new insights into the structure of the graphite–h-BN interface.
石墨和六方氮化硼(h-BN),尽管结构相似,但表现出相反的电子性能,即金属导电性和宽带隙绝缘。近年来,石墨烯-h- bn异质结构引起了人们极大的研究兴趣,由此产生的B-C-N杂化原子层系统具有独特的电子特性。值得注意的是,界面效应对这些异质结构的性能起着决定性的作用。然而,由于缺乏高质量的复合材料,B-C-N材料中的界面结构及其与电荷输运和能带结构调制等关键性质的关系尚不完全清楚。在这里,我们报道了在高压和高温条件下,通过溶剂法直接合成毫米尺寸的六方B-C-N复合材料。结构表征表明,合成的B-C-N复合材料含有分离的石墨和h-BN。与纯h-BN相比,B-C-N复合材料具有更窄的带隙,并且在可见光区表现出明显的光电响应。更有趣的是,我们在石墨- h- bn界面处发现了一种厚度约为30 nm的类石墨B-C化合物,它与石墨形成了肖特基结,从而实现了整流性能。我们的发现为合成高质量的B-C-N复合材料提供了一种方法,并为石墨- h- bn界面结构提供了新的见解。
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引用次数: 0
Structural disorder-driven synthesis of C2+ hydrocarbons via direct hydrogenation of amorphous carbon with continuous random atomic networks 结构无序驱动下连续无序原子网络非晶碳直接加氢合成C2+碳氢化合物
1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-10-20 DOI: 10.1063/5.0293989
Shaojie Wang, Mingtao Li, Zhongyan Wu, Saichao Cao, Penghui Li, Xiang Zhang, Zhiwei Shen, Hongkai Li, Ke Yang, Li Zhang, Guoying Gao, Lin Wang, Yongjun Tian
Recent advances in geoscience have underscored the critical role of abiogenic processes in petroleum formation, especially the formation and polymerization of methane. However, whether a direct carbon–H2 reaction can produce C2+ hydrocarbons (e.g., ethane and propane) beyond methane remains an open question. Here, we demonstrate the direct synthesis of ethane and propane via reactions between amorphous carbon and H2 under upper mantle conditions (2–10 GPa and 800–1200 °C). A systematic investigation reveals that increasing structural disorder in carbon precursors, from graphite to glassy carbon-II and carbon black, enhances the production of C2–C3 hydrocarbons. Through integrated X-ray diffraction and reverse Monte Carlo simulations, we establish that the continuous random atomic network structures in amorphous carbon enable one-step synthesis of heavy hydrocarbons with H2. These models establish a direct link between atomic-scale carbon structures and the one-step synthesis of C2+ hydrocarbons under H2-rich, high-pressure, and high-temperature conditions—potentially revealing an efficient mechanism for the abiotic production of C2+ hydrocarbons in the upper mantle.
地球科学的最新进展强调了非生物成因过程在石油形成中的关键作用,特别是甲烷的形成和聚合。然而,除了甲烷之外,直接的碳-氢反应是否能产生C2+碳氢化合物(如乙烷和丙烷)仍然是一个悬而未决的问题。在上地幔条件下(2-10 GPa, 800-1200℃),无定形碳和H2通过反应直接合成乙烷和丙烷。系统的研究表明,从石墨到玻璃碳- ii和炭黑,碳前体结构的无序性增加,促进了C2-C3烃的生成。通过集成x射线衍射和反向蒙特卡罗模拟,我们确定了非晶碳中的连续随机原子网络结构可以一步合成重碳氢化合物。这些模型建立了原子尺度碳结构与富h2、高压和高温条件下一步合成C2+碳氢化合物之间的直接联系,潜在地揭示了上地幔中非生物生成C2+碳氢化合物的有效机制。
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引用次数: 0
Screening of TiB2-based ternary composites for X-ray transparent heaters in high-pressure and high-temperature experiments 高温高压实验中tib2基三元复合材料x射线透明加热器的筛选
1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2025-09-18 DOI: 10.1063/5.0275504
Zhang Yu-tian, Guoliang Niu, Pengfei Tan, Chuanhui Zhu, Huiyang Gou, David Walker, Man‐Rong Li
High-pressure and high-temperature (HPHT) experiments in large-volume presses (LVPs) benefit from reliable, available, and affordable heaters to achieve stable and homogeneous heating and, in some circumstances, X-ray transparency for monitoring of properties of an in situ experiment using X-ray diffraction and contrast imaging techniques. We have developed heaters meeting the above requirements, and we screen the ternary system TiB2–SiC–hexagonal (h)BN (denoted as TSB) to enable manufacture of X-ray transparent heaters for HPHT runs. Heaters fabricated using optimized TSB-631 (60%TiB2–30%SiC–10%hBN by weight) have been tested in modified truncated assemblies, showing excellent performance up to 22 GPa and 2395 K in HPHT runs. TSB-631 has good ceramic machinability, outstanding reproducibility, high stability, and negligible temperature gradient for runs at 3–7 GPa with cell assemblies with truncated edge lengths of 8–12 mm. The fabricated heaters not only show excellent performance in HPHT runs, but also demonstrate high X-ray transparency over a wide X-ray wavelength region, indicating potential applications for in situ X-ray diffraction/imaging under HPHT conditions in LVPs and other high-pressure apparatus.
大容量压机(lvp)中的高压高温(HPHT)实验得益于可靠、可用和价格合理的加热器,以实现稳定和均匀的加热,在某些情况下,使用x射线衍射和对比成像技术监测原位实验特性的x射线透明度。我们开发了满足上述要求的加热器,并筛选了tib2 - sic -六方(h)BN三元体系(表示为TSB),以制造用于高温高温运行的x射线透明加热器。使用优化的TSB-631 (60%TiB2-30%SiC-10%hBN重量)制造的加热器已经在改进的截尾组件中进行了测试,在高温下运行时表现出优异的性能,最高可达22 GPa和2395 K。TSB-631具有良好的陶瓷可加工性,出色的可重复性,高稳定性和可忽略不计的温度梯度,在3-7 GPa下运行,电池组件的截边长度为8-12 mm。所制备的加热器不仅在高温高压运行中表现出优异的性能,而且在宽x射线波长区域内表现出较高的x射线透明度,这表明了在LVPs和其他高压设备中高温高压条件下的原位x射线衍射/成像的潜在应用。
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引用次数: 1
Compact laser wakefield acceleration toward high energy with micro-plasma parabola 利用微等离子体抛物线实现高能量的紧凑型激光汪场加速
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-09-19 DOI: 10.1063/5.0202964
Xuesong Geng, Tongjun Xu, Lingang Zhang, Igor Kostyukov, Alexander Pukhov, Baifei Shen, Liangliang Ji
Laser wakefield acceleration (LWFA) promises compact accelerators toward the high-energy frontier. However, the approach to the 100 GeV milestone faces the obstacle of the long focal length required for optimal acceleration with high-power lasers, which reaches hundreds of meters for 10–100 PW lasers. The long focal length originates from optimal laser intensity required to avoid nonlinear effects and hence large spot size and Rayleigh length. We propose a “telescope” geometry in which a micro-plasma parabola (MPP) is coupled with a short-focal-length off-axis parabola, minimizing the focal length to the meter range for LWFA under optimized conditions driven by lasers beyond 1 PW. Full-dimensional kinetic simulations demonstrate the generation of a 9 GeV electron bunch within only 1 m optical length—only one-tenth of that required with the conventional approach with the same performance. The proposed MPP provides a basis for the construction of compact LWFAs toward single-stage 100 GeV acceleration with 100 PW class lasers.
激光磁场加速(LWFA)是迈向高能前沿的紧凑型加速器。然而,接近 100 GeV 的里程碑面临着高功率激光器优化加速所需的长焦距障碍,10-100 PW 激光器的焦距可达数百米。长焦距源于避免非线性效应所需的最佳激光强度,因此需要大光斑尺寸和瑞利长度。我们提出了一种 "望远镜 "几何形状,其中微等离子体抛物线 (MPP) 与短焦距离轴抛物线耦合,在 1 PW 以上激光器驱动的优化条件下,将焦距最小化到 LWFA 的米级范围。全维动力学模拟证明,在相同性能的情况下,只需 1 米光长就能产生 9 GeV 电子束,而这只是传统方法所需光长的十分之一。所提出的 MPP 为建造紧凑型 LWFA 提供了基础,以便利用 100 PW 级激光器实现单级 100 GeV 加速。
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引用次数: 0
Hollow ion atomic structure and X-ray emission in dense hot plasmas 高密度热等离子体中的空心离子原子结构和 X 射线发射
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-09-11 DOI: 10.1063/5.0226041
Frank B. Rosmej, Christopher J. Fontes
Hollow ion X-ray emission is of great interest in high-energy-density research, since negligible opacity allows studies from the interior of very dense objects. In this paper, ionization potential depressions of the isoelectronic sequences for single and double K-shell vacancies are obtained from a pure ab initio multiconfiguration Hartree–Fock simulation including exact exchange terms and finite temperature dense plasma effects. It is demonstrated that the simultaneous representation of these ab initio data in the form of a map of hollow ion X-ray transition energies enables identification of important steps in the matter evolution and ionization dynamics. Mapping along the isoelectronic sequence as a function of the pumping energy of a X-ray free electron laser also enables visualization of the impact of ionization potential depression on the pathways of hollow ion formation.
空心离子的 X 射线发射在高能量密度研究中具有重大意义,因为可以忽略的不透明性允许从非常致密的物体内部进行研究。本文从纯 ab initio 多配置 Hartree-Fock 模拟(包括精确交换项和有限温度致密等离子体效应)中获得了单 K 壳空位和双 K 壳空位等电子序列的电离势凹陷。结果表明,以空心离子 X 射线跃迁能量图的形式同时表示这些 ab initio 数据,能够识别物质演化和电离动力学的重要步骤。根据 X 射线自由电子激光器泵浦能量的函数绘制等电子序列图,还能使电离势抑对空心离子形成途径的影响可视化。
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引用次数: 0
Exotic compounds of monovalent calcium synthesized at high pressure 在高压下合成的一价钙的外来化合物
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-09-11 DOI: 10.1063/5.0222230
Jun Kong, Kaiyuan Shi, Artem R. Oganov, Jiaqing Zhang, Lei Su, Xiao Dong
It is well known that atoms of the same element in different valence states show very different chemical behaviors. Calcium is a typical divalent metal, sharing or losing both of its valence electrons when forming compounds. Attempts have been made to synthesize compounds of monovalent calcium ions for decades, but with very little success (e.g., in clusters). Pressure can result in substantial changes in the properties of atoms and chemical bonding, creating an extensive variety of unique materials with special valence states. In this study, using the ab initio evolutionary algorithm USPEX, we search for stable calcium–chlorine (Ca–Cl) system compounds at pressures up to 100 GPa. Besides the expected compound CaCl2, we predict three new compounds with monovalent Ca to be stable at high pressures, namely, CaCl, Ca5Cl6, and Ca3Cl4. According to our calculations, CaCl is stable at pressures above 18 GPa and is predicted to undergo a transition from nonmagnetic Fm-3m-CaCl to ferromagnetic Pm-3m-CaCl at 40 GPa. Ca5Cl6 and Ca3Cl4 are stable at pressures above 37 and 73 GPa, with space groups P-1 and R-3, respectively. Following these predictions, we successfully synthesized Pm-3m-CaCl in laser-heated diamond anvil cell experiments. The emergence of the unusual valence state at high pressures reveals exciting opportunities for creating entirely new materials in sufficiently large quantities for a variety of potential applications.
众所周知,处于不同价态的同种元素原子会表现出截然不同的化学性质。钙是典型的二价金属,在形成化合物时会共享或失去两个价电子。几十年来,人们一直在尝试合成单价钙离子化合物,但收效甚微(如在簇中)。压力可导致原子和化学键的性质发生重大变化,从而创造出种类繁多的具有特殊价态的独特材料。在本研究中,我们利用原子演化算法 USPEX 寻找压力高达 100 GPa 的稳定钙-氯(Ca-Cl)系统化合物。除了预期的 CaCl2 化合物外,我们还预测了三种在高压下稳定的单价 Ca 新化合物,即 CaCl、Ca5Cl6 和 Ca3Cl4。根据我们的计算,CaCl 在 18 GPa 以上的压力下是稳定的,并预测在 40 GPa 时会从非磁性的 Fm-3m-CaCl 转变为铁磁性的 Pm-3m-CaCl。Ca5Cl6 和 Ca3Cl4 在压力高于 37 和 73 GPa 时稳定,空间群分别为 P-1 和 R-3。根据这些预测,我们在激光加热金刚石砧槽实验中成功合成了 Pm-3m-CaCl。在高压下出现不寻常的价态,为我们提供了令人兴奋的机会,可以创造出足够大量的全新材料,用于各种潜在的应用领域。
{"title":"Exotic compounds of monovalent calcium synthesized at high pressure","authors":"Jun Kong, Kaiyuan Shi, Artem R. Oganov, Jiaqing Zhang, Lei Su, Xiao Dong","doi":"10.1063/5.0222230","DOIUrl":"https://doi.org/10.1063/5.0222230","url":null,"abstract":"It is well known that atoms of the same element in different valence states show very different chemical behaviors. Calcium is a typical divalent metal, sharing or losing both of its valence electrons when forming compounds. Attempts have been made to synthesize compounds of monovalent calcium ions for decades, but with very little success (e.g., in clusters). Pressure can result in substantial changes in the properties of atoms and chemical bonding, creating an extensive variety of unique materials with special valence states. In this study, using the ab initio evolutionary algorithm USPEX, we search for stable calcium–chlorine (Ca–Cl) system compounds at pressures up to 100 GPa. Besides the expected compound CaCl2, we predict three new compounds with monovalent Ca to be stable at high pressures, namely, CaCl, Ca5Cl6, and Ca3Cl4. According to our calculations, CaCl is stable at pressures above 18 GPa and is predicted to undergo a transition from nonmagnetic Fm-3m-CaCl to ferromagnetic Pm-3m-CaCl at 40 GPa. Ca5Cl6 and Ca3Cl4 are stable at pressures above 37 and 73 GPa, with space groups P-1 and R-3, respectively. Following these predictions, we successfully synthesized Pm-3m-CaCl in laser-heated diamond anvil cell experiments. The emergence of the unusual valence state at high pressures reveals exciting opportunities for creating entirely new materials in sufficiently large quantities for a variety of potential applications.","PeriodicalId":54221,"journal":{"name":"Matter and Radiation at Extremes","volume":"27 1","pages":""},"PeriodicalIF":5.1,"publicationDate":"2024-09-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142186518","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":1,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Experimental measurements of gamma-photon production and estimation of electron/positron production on the PETAL laser facility PETAL 激光设备上伽马光子产生量的实验测量和电子/正电子产生量的估算
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-09-06 DOI: 10.1063/5.0206416
F. Brun, L. Ribotte, G. Boutoux, X. Davoine, P. E. Masson-Laborde, Y. Sentoku, N. Iwata, N. Blanchot, D. Batani, I. Lantuéjoul, L. Lecherbourg, B. Rosse, C. Rousseaux, B. Vauzour, D. Raffestin, E. D’Humières, X. Ribeyre
This article reports the first measurements of high-energy photons produced with the high-intensity PETawatt Aquitaine Laser (PETAL) laser. The experiments were performed during the commissioning of the laser. The laser had an energy of about 400 J, an intensity of 8 × 1018 W cm−2, and a pulse duration of 660 fs (FWHM). It was shot at a 2 mm-thick solid tungsten target. The high-energy photons were produced mainly from the bremsstrahlung process for relativistic electrons accelerated inside a plasma generated on the front side of the target. This paper reports measurements of electrons, protons and photons. Hot electrons up to ≈35 MeV with a few-MeV temperature were recorded by a spectrometer, called SESAME (Spectre ÉlectronS Angulaire Moyenne Énergie). K- and L-shells were clearly detected by a photon spectrometer called SPECTIX (Spectromètre Petal à Cristal en TransmIssion pour le rayonnnement X). High-energy photons were diagnosed by CRACC-X (Cassette de RAdiographie Centre Chambre-rayonnement X), a bremsstrahlung cannon. Bremsstrahlung cannon analysis is strongly dependent on the hypothesis adopted for the spectral shape. Different shapes can exhibit similar reproductions of the experimental data. To eliminate dependence on the shape hypothesis and to facilitate analysis of the data, simulations of the interaction were performed. To model the mechanisms involved, a simulation chain including hydrodynamic, particle-in-cell, and Monte Carlo simulations was used. The simulations model the preplasma generated at the front of the target by the PETAL laser prepulse, the acceleration of electrons inside the plasma, the generation of MeV-range photons from these electrons, and the response of the detector impacted by the energetic photon beam. All this work enabled reproduction of the experimental data. The high-energy photons produced have a large emission angle and an exponential distribution shape. In addition to the analysis of the photon spectra, positron production was also investigated. Indeed, if high-energy photons are generated inside the solid target, some positron/electron pairs may be produced by the Bethe–Heitler process. Therefore, the positron production achievable within the PETAL laser facility was quantified. To conclude the study, the possibility of creating electron/positron pairs through the linear Breit–Wheeler process with PETAL was investigated.
本文报告了利用高强度 PETawatt Aquitaine 激光器(PETAL)产生的高能光子的首次测量结果。实验是在激光器调试期间进行的。该激光器的能量约为 400 J,强度为 8 × 1018 W cm-2,脉冲持续时间为 660 fs (FWHM)。它被射向一个 2 毫米厚的实心钨靶。高能光子主要产生于在靶前侧产生的等离子体内加速的相对论电子的轫致辐射过程。本文报告了对电子、质子和光子的测量结果。名为 SESAME(Spectre ÉlectronS Angulaire Moyenne Énergie)的光谱仪记录了温度高达 ≈35 MeV 的热电子。名为 SPECTIX(Spectromètre Petal à Cristal en TransmIssion pour le rayonnnement X)的光子光谱仪清楚地探测到了 K 壳和 L 壳。高能光子由 CRACC-X(Cassette de RAdiographie Centre Chambre-rayonnement X)诊断,这是一种轫致辐射炮。轫致辐射加农炮分析在很大程度上取决于对光谱形状所采用的假设。不同形状的光谱可以重现类似的实验数据。为了消除对形状假设的依赖,并便于分析数据,我们对相互作用进行了模拟。为了模拟相关机制,我们使用了一个模拟链,其中包括流体力学模拟、粒子在细胞内模拟和蒙特卡罗模拟。模拟模拟了 PETAL 激光预脉冲在目标前部产生的预等离子体、等离子体内电子的加速、这些电子产生的 MeV 量级光子以及探测器对高能光子束的响应。所有这些工作都使实验数据得以重现。产生的高能光子具有较大的发射角和指数分布形状。除了分析光子光谱外,还研究了正电子的产生。事实上,如果高能光子在固体靶内产生,一些正电子/电子对可能会通过贝特-海特勒过程产生。因此,我们对 PETAL 激光设备可实现的正电子产生量进行了量化。在研究的最后,还研究了利用 PETAL 通过线性布雷特-惠勒过程产生电子/正电子对的可能性。
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引用次数: 0
Benchmark simulations of radiative transfer in participating binary stochastic mixtures in two dimensions 二维参与双随机混合物辐射传递基准模拟
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-08-30 DOI: 10.1063/5.0208236
Cong-Zhang Gao, Ying Cai, Cheng-Wu Huang, Yang Zhao, Jian-Wei Yin, Zheng-Feng Fan, Jia-Min Yang, Pei Wang, Shao-Ping Zhu
We study radiative transfer in participating binary stochastic mixtures in two dimensions (2D) by developing an accurate and efficient simulation tool. For two different sets of physical parameters, 2D benchmark results are presented, and it is found that the influence of the stochastic mixture on radiative transfer is clearly parameter-dependent. Our results confirm that previous multidimensional results obtained in different studies are basically consistent, which is interpreted in terms of the relationship between the photon mean free path lp and the system size L. Nonlinear effects, including those due to scattering and radiation–material coupling, are also discussed. To further understand the particle size effect, we employ a dimensionless parameter lp/L, from which a critical particle size can be derived. On the basis of further 2D simulations, we find that an inhomogeneous mix is obtained for lp/L &gt; 0.1. Furthermore, 2D material temperature distributions reveal that self-shielding and particle–particle shielding of radiation occur, and are enhanced when lp/L is increased. Our work is expected to provide benchmark results to verify proposed homogenized models and/or other codes for stochastic radiative transfer in realistic physical scenarios.
我们通过开发一种精确、高效的模拟工具,研究了二维(2D)参与式二元随机混合物中的辐射传递。对于两组不同的物理参数,我们给出了二维基准结果,发现随机混合物对辐射传递的影响明显取决于参数。我们的结果证实了之前不同研究中获得的多维结果基本一致,这可以从光子平均自由路径 lp 与系统尺寸 L 之间的关系来解释。为了进一步理解粒径效应,我们采用了一个无量纲参数 lp/L,从中可以推导出临界粒径。在进一步二维模拟的基础上,我们发现当 lp/L &gt; 0.1 时会出现不均匀混合。此外,二维材料温度分布显示,辐射会发生自屏蔽和粒子间屏蔽,并且当 lp/L 增加时会增强。我们的工作有望提供基准结果,以验证所提出的均质模型和/或其他代码在现实物理场景中的随机辐射传递。
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引用次数: 0
Fundamental influence of irreversible stress–strain properties in solids on the validity of the ramp loading method 固体不可逆应力应变特性对斜坡加载法有效性的基本影响
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-08-28 DOI: 10.1063/5.0210797
Jingxiang Shen, Wei Kang
The widely used quasi-isentropic ramp loading technique relies heavily on back-calculation methods that convert the measured free-surface velocity profiles to the stress–density states inside the compressed sample. Existing back-calculation methods are based on one-dimensional isentropic hydrodynamic equations, which assume a well-defined functional relationship P(ρ) between the longitudinal stress and density throughout the entire flow field. However, this kind of idealized stress–density relation does not hold in general, because of the complexities introduced by structural phase transitions and/or elastic–plastic response. How and to what extent these standard back-calculation methods may be affected by such inherent complexities is still an unsettled question. Here, we present a close examination using large-scale molecular dynamics (MD) simulations that include the detailed physics of the irreversibly compressed solid samples. We back-calculate the stress–density relation from the MD-simulated rear surface velocity profiles and compare it directly against the stress–density trajectories measured from the MD simulation itself. Deviations exist in the cases studied here, and these turn out to be related to the irreversibility between compression and release. Rarefaction and compression waves are observed to propagate with different sound velocities in some parts of the flow field, violating the basic assumption of isentropic hydrodynamic models and thus leading to systematic back-calculation errors. In particular, the step-like feature of the P(ρ) curve corresponding to phase transition may be completely missed owing to these errors. This kind of mismatch between inherent properties of matter and the basic assumptions of isentropic hydrodynamics has a fundamental influence on how the ramp loading method can be applied.
广泛使用的准各向同性斜坡加载技术在很大程度上依赖于反向计算方法,该方法可将测得的自由表面速度曲线转换为压缩样品内部的应力密度状态。现有的反向计算方法基于一维各向同性流体力学方程,该方程假定整个流场的纵向应力和密度之间存在定义明确的函数关系 P(ρ)。然而,由于结构相变和/或弹塑性响应带来的复杂性,这种理想化的应力-密度关系一般并不成立。这些标准的反向计算方法如何以及在多大程度上会受到这种内在复杂性的影响,仍然是一个悬而未决的问题。在此,我们利用大规模分子动力学(MD)模拟进行了仔细研究,其中包括不可逆压缩固体样品的详细物理过程。我们根据 MD 模拟的后表面速度曲线反向计算应力密度关系,并将其与 MD 模拟本身测得的应力密度轨迹进行直接比较。在本文研究的案例中存在偏差,这些偏差与压缩和释放之间的不可逆性有关。在流场的某些部分,可以观察到稀释波和压缩波以不同的声速传播,这违反了等熵流体力学模型的基本假设,从而导致了系统性的反向计算误差。特别是,由于这些误差,P(ρ) 曲线上与相变相对应的阶梯状特征可能会被完全忽略。物质的固有特性与等熵流体力学基本假设之间的这种不匹配,对如何应用斜坡加载法产生了根本性的影响。
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引用次数: 0
Theoretical model of current propagation in a helical coil with varying geometry and screen tube 具有不同几何形状和屏蔽管的螺旋线圈中电流传播的理论模型
IF 5.1 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Pub Date : 2024-08-26 DOI: 10.1063/5.0221820
C. L. C. Lacoste, A. Hirsch, E. d’Humières, V. T. Tikhonchuk, P. Antici, M. Bardon
An analytical model of current propagation in a helical coil with varying geometry is developed. It can be used for post-acceleration and post-focusing of ions produced via laser-driven target normal sheath acceleration and generation of electromagnetic pulses. We calculate the current that propagates in a helical coil and suggest a method for improving its dispersion properties using a screening tube and with pitch and radius variation. The electromagnetic fields calculated with the analytical model are in agreement with particle-in-cell simulations. The model provides insights into the physics of current propagation in helical coils with varying geometries and enables a numerical implementation for rapid proton spectrum computations, which facilitate the design of such coils for future experiments.
建立了一个电流在不同几何形状的螺旋线圈中传播的分析模型。该模型可用于通过激光驱动的目标法向鞘加速和产生电磁脉冲而产生的离子的后加速和后聚焦。我们计算了在螺旋线圈中传播的电流,并提出了一种使用屏蔽管以及间距和半径变化来改善其分散特性的方法。用分析模型计算出的电磁场与粒子入胞模拟结果一致。该模型深入揭示了电流在不同几何形状的螺旋线圈中传播的物理原理,并可用于快速质子光谱计算的数值实现,这有助于为未来的实验设计此类线圈。
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引用次数: 0
期刊
Matter and Radiation at Extremes
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