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Understanding complex biological macromolecules, especially proteins, is vital for grasping their diverse chemical functions with direct impact in biology and pharmacology. While techniques like X-ray crystallography and cryo-electron…

Biomolecules · Quantitative Biology 2024-04-12 S. H. Mejias , A. L. Cortajarena , R. Mincigrucci , C. Svetina , C. Masciovecchio

Mechanical metamaterials leverage geometric design to achieve unconventional properties, such as high strength at low density, efficient wave guiding, and complex shape morphing. The ability to control shape changes builds on the complex…

Applied Physics · Physics 2025-01-28 Krzysztof K. Dudek , Muamer Kadic , Corentin Coulais , Katia Bertoldi

Structural topology optimization, which aims to find the optimal physical structure that maximizes mechanical performance, is vital in engineering design applications in aerospace, mechanical, and civil engineering. Generative adversarial…

Machine Learning · Computer Science 2022-12-07 François Mazé , Faez Ahmed

The advent of multi-material additive manufacturing and automated composite manufacturing has enabled the design of structures featuring complex curvilinear anisotropy. To take advantage of the new design space, efficient computational…

Applied Physics · Physics 2020-10-05 Kenta Suzuki , Sean E. Phenisee , Marco Salviato

We introduce bidirectional edge diffraction response function (BEDRF), a new approach to model wave diffraction around edges with path tracing. The diffraction part of the wave is expressed as an integration on path space, and the wave-edge…

Sound · Computer Science 2023-06-06 Chunxiao Cao , Zili An , Zhong Ren , Dinesh Manocha , Kun Zhou

In mesh-based numerical simulations, the interpolation of mesh-defined functions across different meshes is a critical task, and achieving high-precision interpolation is of great significance for improving the computational efficiency and…

Numerical Analysis · Mathematics 2026-04-15 Jiaxiong Hao , Yunqing Huang , Nianyu Yi

Additive manufacturing is a free-form manufacturing technique in which parts are built in a layer-by-layer manner. Laser powder bed fusion is one of the popular techniques used to fabricate metal parts. However, it induces residual stress…

Computational Engineering, Finance, and Science · Computer Science 2021-05-07 Takao Miki , Takayuki Yamada

Some response surface functions in complex engineering systems are usually highly nonlinear, unformed, and expensive-to-evaluate. To tackle this challenge, Bayesian optimization, which conducts sequential design via a posterior distribution…

Machine Learning · Statistics 2021-09-23 Areej AlBahar , Inyoung Kim , Xiaowei Yue

There has been increasing experimental evidence of non-affine elastic deformation mechanisms in biological soft tissues. These observations call for novel constitutive models which are able to describe the dominant underlying…

Computational Physics · Physics 2021-03-04 Sebastian Skatulla , Carlo Sansour , Georges Limbert

Open cell foams have diverse industrial applications e.g. heat exchangers, structured reactors, filtration due to their unique properties such as high porosity and high specific surface area. In order to theoretically determine the…

Materials Science · Physics 2015-01-23 Prashant Kumar

This paper presents a computationally efficient method for the optimal design of silica aerogel porous material systems, balancing thermal insulation performance with mechanical stability under stress concentrations. The proposed approach…

Computational Engineering, Finance, and Science · Computer Science 2025-04-03 Pratyush Kumar Singh , Danial Faghihi

A theory of double affine and special double affine bundles, i.e. differential manifolds with two compatible (special) affine bundle structures, is developed as an affine counterpart of the theory of double vector bundles. The motivation…

Differential Geometry · Mathematics 2011-11-22 Janusz Grabowski , Mikolaj Rotkiewicz , Pawel Urbanski

The choice of the shape parameter highly effects the behaviour of radial basis function (RBF) approximations, as it needs to be selected to balance between ill-condition of the interpolation matrix and high accuracy. In this paper, we…

Numerical Analysis · Mathematics 2024-06-26 Fatemeh Nassajian Mojarrad , Maria Han Veiga , Jan S. Hesthaven , Philipp Öffner

A new hyperelastic membrane material model is proposed for single layer blue phosphorus ($\beta\text{-P}$), also known as blue phosphorene. The model is fully nonlinear and captures the anisotropy of $\beta\text{-P}$ at large strains. The…

Materials Science · Physics 2019-02-15 Reza Ghaffari , Farzad Shirazian , Ming Hu , Roger A. Sauer

In this work we develop a high-resolution mapped-grid finite volume method code to model wave propagation in two dimensions in systems of multiple orthotropic poroelastic media and/or fluids, with curved interfaces between different media.…

Numerical Analysis · Mathematics 2013-05-15 Grady I. Lemoine , M. Yvonne Ou

We introduce a new paradigm for immersed finite element and isogeometric methods based on interpolating function spaces from an unfitted background mesh into Lagrange finite element spaces defined on a foreground mesh that captures the…

Numerical Analysis · Mathematics 2023-01-25 Jennifer E. Fromm , Nils Wunsch , Ru Xiang , Han Zhao , Kurt Maute , John A. Evans , David Kamensky

Materials with negative Poisson's ratio, also known as auxetic materials, display exotic properties such as expansion in all directions under uni-axial tension. For their unique properties, these materials find a broad range of applications…

Soft Condensed Matter · Physics 2025-06-05 Sairam Pamulaparthi Venkata , Valentina Balbi , Michel Destradea , Dino Accoto , Giuseppe Zurlo

Amorphous solid water (ASW) is one of the most widely studied solid phase systems. A better understanding of the nature of inter- and intramolecular forces in ASW is, however, still required to correctly interpret the catalytic role of ASW…

Chemical Physics · Physics 2022-04-27 S. Coussan , J. A. Noble , H. M. Cuppen , B. Redlich , S. Ioppolo

The optimization of porous infill structures via local volume constraints has become a popular approach in topology optimization. In some design settings, however, the iterative optimization process converges only slowly, or not at all even…

Computational Engineering, Finance, and Science · Computer Science 2022-03-22 Junpeng Wang , Jun Wu , Rüdiger Westermann

Texture in dense or porous ceramics can enhance their functional and structural properties. Current methods for texturation employ anisotropic particles as starting powders and processes that drive their orientation into specific…