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Nonlinear mechanics of arterial growth 动脉生长的非线性力学
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-23 DOI: 10.1016/j.jmps.2026.106525
Aditya Kumar , Arash Yavari
In this paper, we formulate a geometric theory of the mechanics of arterial growth. An artery is modeled as a finite-length thick shell that is made of an incompressible nonlinear anisotropic solid. An initial radially-symmetric distribution of finite radial and circumferential eigenstrains is also considered. Bulk growth is assumed to be isotropic. A novel framework is proposed to describe the time evolution of growth, governed by a competition between the elastic energy and a growth energy. The governing equations are derived through a two-potential approach and using the Lagrange-d’Alembert principle. An isotropic dissipation potential is considered, which is assumed to be convex in the rate of growth function. Several numerical examples are presented that demonstrate the effectiveness of the proposed model in predicting the evolution of arterial growth and the intricate interplay among eigenstrains, residual stresses, elastic energy, growth energy, and dissipation potential. A distinctive feature of the model is that the growth variable is not constrained by an explicit upper bound; instead, growth naturally approaches a steady-state value as a consequence of the intrinsic energetic competition. Several numerical examples illustrate the efficiency and robustness of the proposed framework in modeling arterial growth.
在本文中,我们提出了动脉生长力学的几何理论。动脉被建模为由不可压缩的非线性各向异性固体组成的有限长厚壳。还考虑了有限径向和周向特征应变的初始径向对称分布。假定体增长是各向同性的。提出了一种描述生长时间演化的新框架,该框架由弹性能和生长能之间的竞争支配。通过双势法和拉格朗日-达朗贝尔原理推导了控制方程。考虑了各向同性耗散势,假设其在生长速率函数中为凸。几个数值算例表明,该模型在预测动脉生长演化以及特征应变、残余应力、弹性能、生长能和耗散势之间复杂的相互作用方面是有效的。该模型的一个显著特征是,增长变量不受明确上界的约束;相反,作为内在的能量竞争的结果,增长自然接近于稳态值。几个数值例子说明了所提出的框架在模拟动脉生长方面的有效性和鲁棒性。
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引用次数: 0
Machine learning-energized framework for rapid and precise inverse design of programmable structures with multiple design variables 基于机器学习的多设计变量可编程结构快速精确反设计框架
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-18 DOI: 10.1016/j.jmps.2026.106524
Qingqing Chen, Chao Yuan, Tiejun Wang
Programmable structures enable autonomous deformation to achieve target three-dimensional (3D) shapes by triggering stimuli-responsive mismatch strain embedded in precursory configurations. However, the growing complexity of target 3D geometries makes it challenging to efficiently and accurately find optimal precursory design variables in a high-dimensional design space. Here, we propose a machine learning-energized framework for rapid and precise inverse design of programmable 3D structures. Firstly, a finite substructure algorithm is proposed to rapidly generate a large-scale database that accurately maps multiple design variables to programmable deformations. To this end, we decompose the full-scale structure into overlapping substructures and employ machine learning to augment the design variable-substructural deformation data pairs from limited finite element analyses. The deformed substructures are then sequentially stitched to reconstruct global deformation by optimal rotation and translation that minimize the Euclidean distance of overlapping regions. Compared to finite element analysis, the proposed finite substructure algorithm accelerates the forward prediction by four orders of magnitude. Based on the large-scale database, a well-trained neural network is obtained to inversely generate the coarse estimation of target design variables, which equips the gradient-free optimization with prior knowledge to approach the optimal result at an accelerated pace. Also, we establish a 3D printing and vacuum actuation platform to validate the inversely designed pneumatically programmable structures. Finally, we show a bio-inspired robotic arm capable of warping and grasping complex 3D objects to highlight the applicability of the proposed inverse design approach. This work provides a feasible paradigm for the inverse design of programmable structures, paving the way for potential applications in soft robotics and deployable devices.
可编程结构通过触发嵌入在前驱结构中的刺激响应不匹配应变,实现自主变形,以实现目标三维(3D)形状。然而,随着目标三维几何形状的日益复杂,如何在高维设计空间中高效、准确地找到最优的前兆设计变量成为一项挑战。在这里,我们提出了一个机器学习驱动的框架,用于可编程3D结构的快速精确逆设计。首先,提出了一种有限子结构算法,快速生成大规模数据库,将多个设计变量精确映射到可编程变形;为此,我们将全尺寸结构分解为重叠的子结构,并使用机器学习来增加来自有限有限元分析的设计变量-子结构变形数据对。然后将变形的子结构依次缝合,通过最小化重叠区域的欧几里得距离的最佳旋转和平移来重建全局变形。与有限元分析相比,本文提出的有限子结构算法将前向预测速度提高了4个数量级。在大规模数据库的基础上,得到训练良好的神经网络逆生成目标设计变量的粗估计,使无梯度优化具有先验知识,加快逼近最优结果。此外,我们还建立了3D打印和真空驱动平台,以验证反设计的气动可编程结构。最后,我们展示了一个能够弯曲和抓取复杂3D物体的仿生机械臂,以突出所提出的逆设计方法的适用性。这项工作为可编程结构的逆向设计提供了一个可行的范例,为软机器人和可部署设备的潜在应用铺平了道路。
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引用次数: 0
Multiscale modeling of coupled thermo-hydro-mechanical- chemical behavior in hydrate-bearing sediment 含水沉积物热-水-力-化学耦合行为的多尺度模拟
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-09 DOI: 10.1016/j.jmps.2026.106512
Jidu Yu , Jidong Zhao , Weijian Liang
This study presents a hybrid continuum-discrete multiscale computational framework that integrates the material point method (MPM) and the discrete element method (DEM) to model fully coupled thermo-hydro-mechanical-chemical (THMC) behavior of hydrate-bearing sediments (HBS). Key innovation of the framework lies in its direct use of DEM to model microscale mechanisms, such as hydrate bond degradation, particle rearrangement, and pore evolution, thereby bypassing the need for conventional elastoplastic constitutive models to define effective stress. We show that a simple hydrate saturation-dependent contact model within the DEM can effectively reproduce characteristic shear and volumetric responses of HBS under various hydrate saturation and confining stresses. By embedding a DEM-based representative volume element (RVE) at each material point in the MPM grid, microscale mechanical behaviors are seamlessly homogenized to inform large-deformation macroscale multiphysics processes. Numerical simulations of biaxial compression and indenter penetration demonstrate the framework’s capability to capture critical phenomena, including shear band formation, shear-induced dilation, and the generation of negative excess pore pressure that drives localized hydrate dissociation. The results further reveal that while higher hydrate saturation enhances shear strength, it also promotes brittle failure and intensified dissociation. Conversely, increased confining stress suppresses volumetric dilation and stabilizes the sediment by mitigating the development of negative pore pressure. This multiscale approach provides a powerful new tool for elucidating complex THMC interactions in HBS, with important implications for assessing hydrate-related geohazards and optimizing gas extraction strategies.
本文提出了一种结合物质点法(MPM)和离散元法(DEM)的连续-离散多尺度混合计算框架,对含水沉积物(HBS)的热-水-机械-化学(THMC)完全耦合行为进行建模。该框架的关键创新在于直接使用DEM来模拟微观尺度机制,如水合物键降解、颗粒重排和孔隙演化,从而绕过了传统弹塑性本构模型来定义有效应力的需要。研究表明,在不同水合物饱和度和围应力条件下,简单的水合物饱和度依赖接触模型可以有效地再现HBS的剪切和体积特征响应。通过在MPM网格中的每个材料点嵌入基于dem的代表性体积单元(RVE),可以无缝地均匀化微尺度力学行为,从而为大变形的宏观多物理场过程提供信息。双轴压缩和压头穿透的数值模拟表明,该框架能够捕获关键现象,包括剪切带形成、剪切引起的膨胀以及产生负超孔隙压力,从而驱动局部水合物解离。结果进一步表明,较高的水合物饱和度在提高抗剪强度的同时,也促进了脆性破坏,加剧了解离。相反,围应力的增加抑制了体积膨胀,并通过减缓负孔隙压力的发展来稳定沉积物。这种多尺度方法为阐明HBS中复杂的THMC相互作用提供了强大的新工具,对评估水合物相关地质灾害和优化天然气开采策略具有重要意义。
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引用次数: 0
Dynamic crushing of metal lattice metamaterials: Shock mode diagrams and transition to topology-independent compaction regime 金属晶格超材料的动态破碎:激波模式图和向拓扑无关压实状态的过渡
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-23 DOI: 10.1016/j.jmps.2026.106515
Brandon K. Zimmerman, Eric B. Herbold, Mukul Kumar, Jonathan Lind
Additively manufactured lattice metamaterials offer design versatility in strength and energy absorption and provide an additional degree of freedom through the selection of the lattice topology. Under quasistatic loading, the unit cell structure can strongly affect the stiffness, yield, and post-yield behavior, but whether and to what degree the effect of lattice topology persists into dynamic loading scenarios, up to the compaction shock regime, has not been established. LLNL’ s ALE3D hydrocode was used to perform a computational investigation of dynamic loading in multiple lattice types, including the gyroid, octet, Schwarz D, and rhombic dodecahedron, under impact velocities from 0.25 to 2.25 km/s. Shock Hugoniots for each lattice topology are generated and compared, suggesting that above a critical velocity, distinctions between architectures may not persevere and compacted lattices behave similarly. To investigate the transition between topology-dependent quasistatic compression and the topology-independent regime above the critical velocity, a one-dimensional elastic-linear hardening plasticity-densified solid (E-LHP-DS) shock model for lattice materials was developed that relies upon confined compression to link the quasistatic and shock mechanics. Unlike similar works, the model does not assume rigid behavior prior to yield or locking behavior at densification, allowing a richer exploration of lattice mechanics. With only six parameters, the analytical model simultaneously fit quasistatic confined compression simulations for relative densities 0.1ρ¯0.9 and predicted dynamic compaction behavior to traverse several distinct shock modes, each defined by a critical impact speed (equivalently, critical stresses). Comparing the numerical results to the one-dimensional E-LHP-DS shock model predictions suggests that the topology-independence under strong shocks is linked to the onset of densification, which can be predicted based on quasistatic confined compression results.
增材制造的晶格超材料在强度和能量吸收方面提供了设计上的通用性,并通过选择晶格拓扑提供了额外的自由度。在准静态加载下,单胞结构可以强烈地影响刚度、屈服和后屈服行为,但晶格拓扑的影响是否以及在多大程度上持续到动态加载场景,直到压实冲击状态,还没有确定。利用LLNL的ALE3D氢代码对冲击速度为0.25 ~ 2.25 km/s的多种晶格类型(包括回转体、八面体、Schwarz D和菱形十二面体)的动载荷进行了计算研究。我们生成并比较了每个晶格拓扑的震荡Hugoniots,这表明在临界速度以上,结构之间的区别可能不会持久,而压缩晶格的行为相似。为了研究临界速度以上拓扑相关准静态压缩和拓扑无关压缩之间的转变,建立了晶格材料的一维弹性线性硬化塑性致密固体(E-LHP-DS)冲击模型,该模型依赖于受限压缩将准静态力学和冲击力学联系起来。与类似的工作不同,该模型不假设在屈服之前的刚性行为或致密化时的锁定行为,允许对晶格力学进行更丰富的探索。该分析模型只有6个参数,同时适合相对密度0.1≤ρ¯≤0.9的准静态受限压缩模拟,并预测了动态压缩行为,以穿越几种不同的冲击模式,每种冲击模式都由临界冲击速度(相当于临界应力)定义。将数值结果与一维E-LHP-DS冲击模型预测结果进行比较表明,强冲击下的拓扑独立性与致密化的发生有关,致密化可以基于准静态受限压缩结果进行预测。
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引用次数: 0
Contact in strain gradient elasticity: The rigid flat punch problem 应变梯度弹性中的接触:刚性平冲问题
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-23 DOI: 10.1016/j.jmps.2026.106527
P.A. Gourgiotis , Th. Zisis , A.E. Giannakopoulos , H.G. Georgiadis
This work revisits the classical flat-punch indentation problem within the framework of Mindlin’s form-II strain-gradient elasticity, uncovering new phenomena driven by the interplay between contact geometry and material length scale. The analysis is carried out under plane strain conditions, and the corresponding mixed boundary value problem is solved using integral equation techniques. Two distinct contact regimes are examined. In the first, assuming full contact beneath the rigid indenter, the pressure distribution exhibits hypersingular behavior with tensile (adhesive-like) tractions near the contact edges. These arise purely from kinematic constraints, without invoking any cohesive law or surface energy. The second regime emerges by relaxing the flatness assumption, allowing for partial separation beneath the punch. In this case, contact is sustained only within a central region, flanked by separation gaps near the edges and balanced by concentrated edge reactions. The resulting pressure is entirely positive and exhibits a classical square-root singularity. Both the contact width and edge forces are shown to depend sensitively on Poisson’s ratio and the material length scale. Beyond a critical length, the contact region collapses, and the problem reduces to the superposition of two Flamant-type concentrated contact solutions. These findings reveal a rich class of indentation responses naturally captured by strain gradient elasticity-phenomena inaccessible to classical continuum models. They may have important implications for nano/micro-indentation experiments on materials with pronounced internal length scales, such as polymers, ceramics, composites, cellular solids, masonry, and biological tissues.
这项工作在Mindlin的ii型应变梯度弹性框架内重新审视了经典的平冲压痕问题,揭示了接触几何形状和材料长度尺度之间相互作用驱动的新现象。在平面应变条件下进行了分析,采用积分方程技术求解了相应的混合边值问题。研究了两种不同的接触机制。在第一种情况下,假设刚性压头下方完全接触,压力分布表现出超奇异行为,在接触边缘附近具有拉伸(类似粘合剂)牵引力。这些纯粹是由运动学约束产生的,而不调用任何内聚定律或表面能。第二种机制是通过放松平面假设,允许冲孔下方部分分离而出现的。在这种情况下,接触仅在中心区域内维持,两侧是靠近边缘的分离间隙,并通过集中的边缘反应来平衡。由此产生的压力完全是正的,并表现出经典的平方根奇点。两者的接触宽度和边缘力显示敏感地依赖于泊松比和材料长度尺度。超过临界长度后,接触区域坍塌,问题就变成了两种flamant型浓缩接触溶液的叠加。这些发现揭示了一种丰富的压痕响应类别,自然地被应变梯度弹性捕获-经典连续体模型无法获得的现象。它们可能对具有明显内部长度尺度的材料(如聚合物、陶瓷、复合材料、细胞固体、砌体和生物组织)的纳米/微压痕实验具有重要意义。
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引用次数: 0
Generalized configurational force for thermoelasticity with application to isogeometric analysis of thermoelastic crack propagation 热弹性广义构形力及其在热弹性裂纹扩展等几何分析中的应用
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-02-03 DOI: 10.1016/j.jmps.2026.106541
Chung-Shuo Lee, Pei-En Chou, Ganesh Subbarayan
Accurately predicting the forces driving crack propagation is critical for engineering applications where fracture is an important failure criterion. An easy to apply configurational force theory for estimating crack driving force in thermoelastic solids is derived in this study. The derivation relies on the notion of a configurational optimization problem for heterogeneities inserted into a homogeneous domain. The configurational optimization allows arbitrary objectives subject to constraints of variational principles governing the solid behavior. The optimality criteria obtained by solving an adjoint problem naturally yields a generalized Eshelby Energy-Momentum tensor, which leads to the classical J, L and M integrals of fracture mechanics when Helmholtz free energy is chosen as the objective and the problem is constrained to be isothermal. We calculate the configurational force using an isogeometric computational framework that relies on a recently developed enrichment procedure for multi-material corner singularities, of which cracks are a special case. Enriched displacement and temperature functions applied at crack tips are illustrated and demonstrated through several numerical examples on thermoelastic solids. Examples include (a) crack driving force estimation under adiabatic/isothermal conditions, (b) edge crack propagation simulation and (c) bimaterial wedge under varying mechanical and thermal loadings.
在断裂是重要破坏准则的工程应用中,准确预测驱动裂纹扩展的力至关重要。本文推导了一种易于应用的热弹性固体裂纹驱动力计算的构形力理论。推导依赖于插入到齐次域中的异构的构型优化问题的概念。结构优化允许任意目标服从于控制固体行为的变分原则的约束。通过求解伴随问题得到的最优性准则自然产生广义的Eshelby能量-动量张量,当选择Helmholtz自由能作为目标并将问题限制为等温时,可得到经典的断裂力学J−,L−和M−积分。我们使用一个等几何计算框架来计算构型力,该框架依赖于最近开发的多材料角点奇点的浓缩程序,其中裂纹是一个特殊情况。通过几个热弹性固体的数值例子,说明了裂纹尖端的丰富位移和温度函数。例子包括(a)绝热/等温条件下的裂纹驱动力估计,(b)边缘裂纹扩展模拟和(c)不同机械和热载荷下的双材料楔。
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引用次数: 0
Coupled grain-pore fabric evolutions in sheared granular materials: Anisotropy lagging and geometric emergence 剪切颗粒材料中耦合颗粒-孔隙结构演化:各向异性滞后和几何涌现
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-29 DOI: 10.1016/j.jmps.2026.106530
Amiya Prakash Das , Jidong Zhao , Thomas Sweijen
The morphological evolution of pore spaces is a critical yet poorly quantified microstructural determinant of the macroscopic mechanical and hydraulic behavior of granular materials. While the anisotropy of the grain contact network (Fc) is known to dictate material response, the concurrent evolution of pore space anisotropy (Fp) and its coupling with Fc remains inadequately understood. This study employs Minkowski moment tensor analysis within a Discrete Element Method (DEM) framework to bridge this gap. We systematically investigate dense and loose, monodisperse and polydisperse assemblies under cyclic triaxial loading to quantify the dynamic coupling between Fc and Fp. We demonstrate a moderate to strong correlation between Fc and Fp, with a systematic lag in the response of Fp attributed to hierarchical geometric emergence across scales. This lag is constrained by particle-scale free-volume reorganization and its kinematic compatibility with particle motion. Additionally, key pore-scale metrics, including inverse Voronoi cell fractions (ϕv1), pore-scale porosity (ϕp), and pore shape anisotropy β^, are well described by gamma distributions across all packing densities and strain levels. Notably, the scaled ϕv1 follows a k-gamma distribution, providing a statistically consistent descriptor for volume fluctuations. A strong correlation is also observed between the average pore shape factor (|β|avg) and global porosity, suggesting that |β|avg serves as a geometry-based descriptor linking collective pore deformation to packing density. These findings underscore the utility of the Minkowski tensor approach in capturing 3D fabric evolution and explicitly linking pore- and grain-scale interactions. The quantitative relationships and statistical descriptors presented here provide a new foundation for enhancing constitutive models in geotechnics and powder technology, offering insights relevant to future investigations into permeability evolution and shear band formation.
孔隙空间的形态演化是颗粒材料宏观力学和水力行为的一个关键但量化不足的微观结构决定因素。虽然已知颗粒接触网络(Fc)的各向异性决定了材料的响应,但孔隙空间各向异性(Fp)的同步演化及其与Fc的耦合仍然没有得到充分的了解。本研究采用离散元法(DEM)框架内的闵可夫斯基矩张量分析来弥补这一差距。我们系统地研究了密集和松散、单分散和多分散组件在循环三轴载荷下的动态耦合。我们证明了Fc和Fp之间存在中度到强烈的相关性,而Fp的响应存在系统性滞后,这归因于不同尺度的分层几何涌现。这种滞后受到粒子尺度自由体积重组及其与粒子运动的运动学相容性的限制。此外,关键的孔隙尺度指标,包括逆Voronoi细胞分数(ϕv−1),孔隙尺度孔隙率(ϕp)和孔隙形状各向异性β^,都可以通过所有充填密度和应变水平的伽马分布来很好地描述。值得注意的是,缩放后的ϕv−1遵循k-gamma分布,为体积波动提供了统计上一致的描述符。平均孔隙形状因子(|β|avg)与整体孔隙度之间也存在很强的相关性,表明|β|avg可以作为一个基于几何的描述符,将孔隙集体变形与充填密度联系起来。这些发现强调了闵可夫斯基张量方法在捕捉三维织物演化和明确连接孔隙和颗粒尺度相互作用方面的实用性。本文提出的定量关系和统计描述符为增强岩土工程和粉末技术中的本构模型提供了新的基础,为未来研究渗透率演化和剪切带形成提供了相关见解。
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引用次数: 0
Toggling energy landscape to enable commutative and non-commutative responses in multistable structures 在多稳定结构中切换能量格局以启用交换和非交换响应
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-02-03 DOI: 10.1016/j.jmps.2026.106544
Lei Wu, Damiano Pasini
The deformation of a structure may be either insensitive or sensitive to the sequence of the applied forces: the former corresponds to a commutative response, whereas the latter indicates a non-commutative response. Among diverse physical systems, an elastic multistable structure tessellated from bistable units or bits can display commutative or non-commutative responses, each dictated by the manner of interaction between the units. In this work, we elucidate the underlying physics of commutative and non-commutative responses through the lens of the energy landscape of a multistable structure, and demonstrate that initially non-commutative units can be toggled to become commutative by altering the number and distribution of local energy minima in their state space, thus enabling reprogrammable sensitivity to the loading sequence. The concept is realized and demonstrated as a multistable switch in an electrical circuit capable of offering in situ adjustable levels of information protection through reprogrammable sequence sensitivity.
结构的变形可能对施加力的顺序不敏感或敏感:前者对应于交换响应,而后者则表示非交换响应。在不同的物理系统中,由双稳态单元或位镶嵌而成的弹性多稳态结构可以显示交换或非交换响应,每个响应都由单元之间的相互作用方式决定。在这项工作中,我们通过多稳定结构的能量景观镜头阐明了交换和非交换响应的基本物理,并证明了最初的非交换单元可以通过改变其状态空间中局部能量最小值的数量和分布来切换为交换单元,从而实现对加载序列的可重新编程灵敏度。该概念被实现并演示为电路中的多稳态开关,能够通过可重新编程的序列灵敏度提供现场可调的信息保护水平。
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引用次数: 0
3D phase-field modeling of H2→H3 phase transition induced intragranular cracking in single-crystal Ni-rich layered cathodes 富镍单晶层状阴极H2→H3相变致晶内裂纹的三维相场模拟
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-23 DOI: 10.1016/j.jmps.2026.106528
Zhengtao Liao , Xiangbiao Liao , Yuyang Lu , Chengcheng Cao , Linghui He , Yong Ni
Understanding the intragranular cracking mechanisms of single-crystal Ni-rich layered cathodes (SCNCM) during electrochemical cycling is essential for next-generation high-energy-density and long-life Li-ion batteries. However, the complex interplay among the factors driving crack initiation and propagation remains unclear. Herein, we present a fully coupled three-dimensional phase-field model that integrates anisotropic lithium diffusion, the H2-H3 structural phase transition, stress evolution, and fracture mechanics to elucidate intragranular fracture in SCNCM during deep delithiation. Simulations on representative particle geometries reveal that anisotropic diffusion and fracture energy alone can not initiate layer-parallel cracks, instead, layered delithiation pathways govern shape-dependent phase transition dynamics, while lattice mismatch from spatially heterogeneous phase transitions nucleates cracks preferentially at particle surfaces and drives their propagation along layered planes, in good agreement with experimental observations. Cubic particles with uniform layers form cracks prematurely, whereas spherical and octahedral particles—with shorter surface layers—delay crack initiation by 5.3% state of charge (SoC) due to retarded phase transition in central layers, thereby expanding the safe-charging window. Elevated charging rates accelerate central-layer phase transition, amplifying misfit and triggering earlier cracking, while reduced phase-transition eigenstrain or flatter aspect ratios mitigate stress concentrations and suppress damage. These results establish a predictive link between phase transition dynamics and intragranular fracture, providing design strategies for mechanically robust high-energy-density cathodes.
了解电化学循环过程中单晶富镍层状阴极(SCNCM)的晶内开裂机制对下一代高能量密度和长寿命锂离子电池至关重要。然而,驱动裂纹萌生和扩展的因素之间复杂的相互作用仍不清楚。在此,我们提出了一个全耦合的三维相场模型,该模型集成了各向异性锂扩散、H2-H3结构相变、应力演化和断裂力学,以阐明SCNCM在深度剥蚀过程中的晶内断裂。对典型颗粒几何形状的模拟表明,各向异性扩散和断裂能本身不能引发层平行裂纹,相反,层状衰减路径控制着形状相关的相变动力学,而空间非均质相变导致的晶格失配优先在颗粒表面形成裂纹,并驱动裂纹沿层状面扩展,这与实验观察结果吻合良好。具有均匀层的立方粒子过早形成裂纹,而具有较短表面层的球形和八面体粒子由于中心层的相变延迟,延迟了5.3%的荷电状态(SoC),从而扩大了安全充电窗口。升高的充注速率加速了中间层的相变,放大了错配,引发了早期的开裂,而降低的相变特征应变或平坦的长径比则缓解了应力集中,抑制了损伤。这些结果建立了相变动力学与晶内断裂之间的预测联系,为机械坚固的高能量密度阴极的设计提供了策略。
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引用次数: 0
A generalized higher-order phase-field model for brittle fracture in anisotropic rocks 各向异性岩石脆性断裂的广义高阶相场模型
IF 6 2区 工程技术 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-04-01 Epub Date: 2026-01-27 DOI: 10.1016/j.jmps.2026.106526
Sijia Liu , Yunteng Wang , Xueyu Geng , Wei Wu
In this work, we formulate a generalized higher-order phase-field model within the rotated anisotropic framework for simulating brittle phenomena in anisotropic rocks. Our phase-field model accounts for both the anisotropic critical fracture energy release rate and the anisotropic degradation in stiffness. The innovative aspects of this model include (i) a fourth-order structural tensor enabling simulations of strongly anisotropic fractures with arbitrary, non-orthogonal symmetry axes for capturing the complexity of natural geological media; (ii) a volumetric–deviatoric coupling energy density for transitions from anisotropic responses in the undamaged state to isotropic responses in the damaged state; (iii) a patch-based Hessian recovery algorithm ensuring stable solutions of the higher-order PDEs to reduce the computational cost; and (iv) stochastic perturbations integrated into the anisotropic crack surface density function to capture microstructural heterogeneity. Several numerical benchmark examples are provided. The numerical results are compared with some laboratory experiments on brittle fracture in anisotropic rocks.
在这项工作中,我们建立了一个在旋转各向异性框架内的广义高阶相场模型来模拟各向异性岩石中的脆性现象。我们的相场模型考虑了各向异性临界断裂能量释放率和刚度的各向异性退化。该模型的创新之处包括(i)一个四阶结构张量,可以模拟具有任意非正交对称轴的强各向异性裂缝,以捕捉自然地质介质的复杂性;(ii)从未损伤状态的各向异性响应到损伤状态的各向同性响应的体积-偏差耦合能量密度;(iii)基于patch的Hessian恢复算法,保证高阶偏微分方程解稳定,降低计算成本;(iv)将随机扰动集成到各向异性裂纹表面密度函数中,以捕获微观结构的非均质性。给出了几个数值基准算例。数值结果与一些各向异性岩石脆性断裂的室内实验结果进行了比较。
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引用次数: 0
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Journal of The Mechanics and Physics of Solids
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