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The marriage of density functional theory (DFT) and deep learning methods has the potential to revolutionize modern computational materials science. Here we develop a deep neural network approach to represent DFT Hamiltonian (DeepH) of…

Materials Science · Physics 2023-01-02 He Li , Zun Wang , Nianlong Zou , Meng Ye , Runzhang Xu , Xiaoxun Gong , Wenhui Duan , Yong Xu

Fast, high-order accurate algorithms for electromagnetic scattering from axisymmetric objects are of great importance when modeling physical phenomena in optics, materials science (e.g. meta-materials), and many other fields of applied…

Numerical Analysis · Mathematics 2019-05-22 Jun Lai , Michael O'Neil

To address limitations of the graph fractional Fourier transform (GFRFT) Wiener filtering and the traditional joint time-vertex fractional Fourier transform (JFRFT) Wiener filtering, this study proposes a filtering method based on the…

Signal Processing · Electrical Eng. & Systems 2025-07-30 Ziqi Yan , Zhichao Zhang

In this letter, a fast Fourier transform (FFT)-enhanced low-complexity super-resolution sensing algorithm for near-field source localization with both angle and range estimation is proposed. Most traditional near-field source localization…

Signal Processing · Electrical Eng. & Systems 2024-11-26 Yuxiao Wu , Huizhi Wang , Yong Zeng

FFT-based solvers are increasingly used by many researcher groups interested in modelling the mechanical behavior associated to a heterogeneous microstructure. A development is reported here that concerns the viscoelastic behavior of…

Classical Physics · Physics 2020-12-07 Stéphane André , Julien Boisse , Camille Noûs

This paper presents a homogenization framework for elastomeric metamaterials exhibiting long-range correlated fluctuation fields. Based on full-scale numerical simulations on a class of such materials, an ansatz is proposed that allows to…

Soft Condensed Matter · Physics 2018-10-29 O. Rokoš , M. M. Ameen , R. H. J. Peerlings , M. G. D. Geers

We present a new framework for the simultaneous optimiziation of both the topology as well as the relative density grading of cellular structures and materials, also known as lattices. Due to manufacturing constraints, the optimization…

Computational Engineering, Finance, and Science · Computer Science 2025-05-27 Jonathan Stollberg , Tarun Gangwar , Oliver Weeger , Dominik Schillinger

Using a powerful homogenization technique, one- and two-dimensional graphene metasurfaces are homogenized both at the fundamental frequency (FF) and second harmonic (SH). In both cases, there is excellent agreement between the predictions…

Optics · Physics 2019-05-17 Qun Ren , J. W. You , N. C. Panoiu

We introduce a new Partition of Unity Method for the numerical homogenization of elliptic partial differential equations with arbitrarily rough coefficients. We do not restrict to a particular ansatz space or the existence of a finite…

Numerical Analysis · Mathematics 2016-05-04 Daniel Peterseim , Patrick Henning , Philipp Morgenstern

Many interesting and fundamentally practical optimization problems, ranging from optics, to signal processing, to radar and acoustics, involve constraints on the Fourier transform of a function. It is well-known that the {\em fast Fourier…

Optimization and Control · Mathematics 2012-09-05 Robert J. Vanderbei

In modern digital filter chip design, efficient resource utilization is a hot topic. Due to the linear phase characteristics of FIR filters, a pulsed fully parallel structure can be applied to address the problem. To further reduce hardware…

Hardware Architecture · Computer Science 2023-11-27 Mengwei Hu , Zhengxiong Li , Xianyang Jiang

We consider the Fast Fourier Transform (FFT) based numerical method for thin film magnetization problems [Vestg{\aa}rden and Johansen, SuST, 25 (2012) 104001], compare it with the finite element methods, and evaluate its accuracy. Proposed…

Computational Physics · Physics 2018-05-09 Leonid Prigozhin , Vladimir Sokolovsky

Fourier-accelerated micromechanical homogenization has been developed and applied to a variety of problems, despite being prone to ringing artifacts. In addition, the majority of Fourier-accelerated solvers applied to FFT-accelerated…

Numerical Analysis · Mathematics 2022-07-22 Ali Falsafi , Richard J. Leute , Martin Ladecký , Till Junge

Computational homogenization is the gold standard for concurrent multi-scale simulations (e.g., FE2) in scale-bridging applications. Experimental and synthetic material microstructures are often represented by 3D image data. The…

Numerical Analysis · Mathematics 2022-09-07 Sanath Keshav , Felix Fritzen , Matthias Kabel

Problems with localized nonhomogeneous material properties arise frequently in many applications and are a well-known source of difficulty in numerical simulations. In certain applications (including additive manufacturing), the physics of…

Numerical Analysis · Mathematics 2020-04-22 Alex Viguerie , Silvia Bertoluzza , Ferdinando Auricchio

This work focuses on computing the homogenized elastic properties of rocks from 3D micro-computed-tomography (micro-CT) scanned images. The accurate computation of homogenized properties of rocks, archetypal random media, requires both…

Geophysics · Physics 2023-04-06 Rasool Ahmad , Mingliang Liu , Michael Ortiz , Tapan Mukerji , Wei Cai

We present the design and implementation details of a geometric multigrid method on adaptively refined meshes for massively parallel computations. The method uses local smoothing on the refined part of the mesh. Partitioning is achieved by…

Numerical Analysis · Computer Science 2021-08-04 Thomas C. Clevenger , Timo Heister , Guido Kanschat , Martin Kronbichler

Water quality data can supply a substantial decision support for water resources utilization and pollution prevention. However, there are numerous missing values in water quality data due to inescapable factors like sensor failure, thereby…

Machine Learning · Computer Science 2025-03-11 Qian Liu , Lan Wang , Bing Yang , Hao Wu

Designing functional materials requires a deep search through multidimensional spaces for system parameters that yield desirable material properties. For cases where conventional parameter sweeps or trial-and-error sampling are impractical,…

Materials Science · Physics 2022-03-22 Sanket Kadulkar , Zachary M. Sherman , Venkat Ganesan , Thomas M. Truskett

Numerical homogenization and multiscale finite element methods construct effective properties on a coarse grid by solving local problems and extracting the average effective properties from these local solutions. In some cases, the…

Numerical Analysis · Mathematics 2016-06-21 Eric T. Chung , Yalchin Efendiev , Wing Tat Leung , Maria Vasilyeva