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A formulation of the asymptotically exact first-order shear deformation theory for linear-elastic homogeneous plates in the rescaled coordinates and rotation angles is considered. This allows the development of its asymptotically accurate…

Numerical Analysis · Mathematics 2024-04-17 Khanh Chau Le , Hoang Giang Bui

This paper studies a two-phase material with a microstructure composed of a hard brittle reinforcement phase embedded in a soft ductile matrix. It addresses the full three-dimensional nature of the microstructure and macroscopic…

Materials Science · Physics 2016-04-14 T. W. J. de Geus , M. Cottura , B. Appolaire , R. H. J. Peerlings , M. G. D. Geers

This paper focuses on the isogeometric vibration analysis of curvilinearly stiffened composite panels. The stiffness matrices and the mass matrices are derived using the first-order shear deformation theory (FSDT). The present method models…

Computational Engineering, Finance, and Science · Computer Science 2024-11-26 Balakrishnan Devarajan

We consider a Navier-Stokes fluid-plate interaction (FSI) system which describes the evolutions of the fluid contained within a 3D cavity, as it interacts with a deformable elastic membrane on the ``free" upper boundary of the cavity. These…

Analysis of PDEs · Mathematics 2025-07-04 Pelin G. Geredeli , Quyuan Lin , Dylan Mcknight , Mohammad Mahabubur Rahman

We present a computational approach for electronically correlated metallic surfaces and interfaces, which combines Density Functional and Dynamical Mean Field Theory using a multi-orbital perturbative solver for the many-body problem. Our…

Strongly Correlated Electrons · Physics 2022-04-06 Andrea Droghetti , Miloš M. Radonjić , Anita Halder , Ivan Rungger , Liviu Chioncel

We present an embedding technique for metallic systems that makes it possible to model energy dissipation into substrate phonons during surface chemical reactions from first principles. The separation of chemical and elastic contributions…

Materials Science · Physics 2014-05-14 Jörg Meyer , Karsten Reuter

This paper investigates finite-element modeling of a vertically damped free-standing rocking column. The paper first derives the nonlinear equation of motion for the coupled system and then compares the analytical solution with…

Applied Physics · Physics 2022-06-29 Mehrdad Aghagholizadeh

We present a mesoscale description of deformations and defects in thin, flexible sheets with crystalline order, tackling the interplay between in-plane elasticity, out-of-plane deformation, as well as dislocation nucleation and motion. Our…

Materials Science · Physics 2025-02-26 Lucas Benoit--Maréchal , Ingo Nitschke , Axel Voigt , Marco Salvalaglio

Density functional theory (DFT) calculations are used to investigate the electronic and magnetic structures of a two-dimensional (2D) monolayer Li$_{2}$N. It is shown that bulk Li$_{3}$N is a non-magnetic semiconductor. The…

Materials Science · Physics 2017-12-06 Gul Rahman , Altaf Ur Rahman , Saima Kanwal , P. Kratzer

Electrohydrodynamic flows of weak electrolytes at the nanoscale are significantly influenced by the molecular structure of water-like polar solvents within the electric double layer (EDL). Moreover, unlike in microfluidics, at these length…

Fluid Dynamics · Physics 2026-03-16 Pramodt Srinivasula

The interaction among quasi-geostrophic mesoscale eddies, submesoscale fronts, and boundary layer turbulence (BLT) is a central problem in upper ocean dynamics. We investigate these multiscale dynamics using a novel large-eddy simulation on…

Fluid Dynamics · Physics 2026-04-21 S. Peng , S. Silvestri , A. Bodner

Design and analysis of inelastic materials requires prediction of physical responses that evolve under loading. Numerical simulation of such behavior using finite element (FE) approaches can call for significant time and computational…

Materials Science · Physics 2025-07-08 Indrashish Saha , Ashwini Gupta , Lori Graham-Brady

This study presents the analytical formulation and the finite element solution of fractional order nonlocal plates under both Mindlin and Kirchoff formulations. By employing consistent definitions for fractional-order kinematic relations,…

Computational Engineering, Finance, and Science · Computer Science 2021-02-03 Sansit Patnaik , Sai Sidhardh , Fabio Semperlotti

We provide a minimal continuum model for mesoscale plasticity, explaining the cellular dislocation structures observed in deformed crystals. Our dislocation density tensor evolves from random, smooth initial conditions to form self-similar…

Materials Science · Physics 2010-09-03 Yong S. Chen , Woosong Choi , Stefanos Papanikolaou , James P. Sethna

Hydrokinetic flapping foil turbines in swing-arm mode have gained considerable interest in recent years because of their enhanced capability to extract power, and improved efficiency compared to foils in simple mode. The performance of foil…

Fluid Dynamics · Physics 2023-02-28 Ahmed A. Hamada , Mirjam Fürth

Dynamic density functional theory (DDFT) is a promising approach for predicting the structural evolution of a drying suspension containing one or more types of colloidal particles. The assumed free-energy functional is a key component of…

Soft Condensed Matter · Physics 2022-11-23 Mayukh Kundu , Michael P. Howard

Fourier solvers have become efficient tools to establish structure-property relations in heterogeneous materials. Introduced as an alternative to the Finite Element (FE) method, they are based on fixed-point solutions of the…

Computational Physics · Physics 2017-09-01 Jan Zeman , Tom W. J. de Geus , Jaroslav Vondřejc , Ron H. J. Peerlings , Marc G. D. Geers

A vertical slice model is developed for the Euler-Boussinesq equations with a constant temperature gradient in the direction normal to the slice (the Eady-Boussinesq model). The model is a solution of the full three-dimensional equations…

Numerical Analysis · Mathematics 2017-11-27 Hiroe Yamazaki , Jemma Shipton , Michael J. P. Cullen , Lawrence Mitchell , Colin J. Cotter

Density functional theory (DFT) embedding provides a formally exact framework for interfacing correlated wave-function theory (WFT) methods with lower-level descriptions of electronic structure. Here, we report techniques to improve the…

Chemical Physics · Physics 2015-06-12 Jason D. Goodpaster , Taylor A. Barnes , Frederick R. Manby , Thomas F. Miller

In this article we address the theoretical study of a multiscale drift-diffusion (DD) model for the description of photoconversion mechanisms in organic solar cells. The multiscale nature of the formulation is based on the co-presence of…

Applied Physics · Physics 2018-02-14 Maurizio Verri , Matteo Porro , Riccardo Sacco , Sandro Salsa