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The eXtended Finite Element Method (XFEM) is used to solve interface problems with an unfitted mesh. We present an implementation of the XFEM in the FEM-library deal.II. The main parts of the implementation are (i) the appropriate…

Numerical Analysis · Mathematics 2015-07-16 Thomas Carraro , Sven Wetterauer

InferPy is a Python package for probabilistic modeling with deep neural networks. It defines a user-friendly API that trades-off model complexity with ease of use, unlike other libraries whose focus is on dealing with very general…

Machine Learning · Computer Science 2020-02-13 Javier Cózar , Rafael Cabañas , Antonio Salmerón , Andrés R. Masegosa

Virtual reality simulation has become a popular approach for training and assessing medical students. It offers diverse scenarios, realistic visuals, and quantitative performance metrics for objective evaluation. However, creating these…

Software Engineering · Computer Science 2023-11-27 Vladimir Poliakov , Dzmitry Tsetserukou , Emmanuel Vander Poorten

Damping of structures and systems is often dominated by frictional dissipation in connections, the prediction of which remains a longstanding scientific challenge. Previous studies have shown that the actual topography of contact interfaces…

Computational Engineering, Finance, and Science · Computer Science 2026-03-30 Hendrik D. Linder , David A. Najera-Flores , Robert J. Kuether , Malte Krack

In this paper we analyze a space-time unfitted finite element method for the discretization of scalar surface partial differential equations on evolving surfaces. For higher order approximations of the evolving surface we use the technique…

Numerical Analysis · Mathematics 2024-11-26 Arnold Reusken , Hauke Sass

In silico materials design is hampered by the computational complexity of Kohn-Sham DFT, which scales cubically with the system size. Owing to the development of new-generation kinetic energy density functionals (KEDFs), orbital-free DFT…

Computational Physics · Physics 2020-08-24 Xuecheng Shao , Kaili Jiang , Wenhui Mi , Alessandro Genova , Michele Pavanello

We present a high-level domain-specific language (DSL) interface to drive an adaptive incomplete $k$-d tree-based framework for finite element (FEM) solutions to PDEs. This DSL provides three key advances: (a) it abstracts out the…

Computational Engineering, Finance, and Science · Computer Science 2023-06-01 Eric Heisler , Cheng-Hau Yang , Aadesh Deshmukh , Baskar Ganapathysubramanian , Hari Sundar

(Partial) differential equations (PDEs) are fundamental tools for describing natural phenomena, making their solution crucial in science and engineering. While traditional methods, such as the finite element method, provide reliable…

Machine Learning · Computer Science 2025-03-11 Viggo Moro , Luiz F. O. Chamon

Python is known to be a versatile language, well suited both for beginners and advanced users. Some elements of the language are easier to understand than others: some are found in any kind of code, while some others are used only by…

Many problems in physics are inherently of multi-scale nature. The issues of MHD turbulence or magnetic reconnection, namely in the hot and sparse, almost collision-less astrophysical plasmas, can stand as clear examples. The Finite Element…

Computational Physics · Physics 2012-06-14 Jan Skala , Miroslav Barta

The purpose of this work is to introduce and analyze a numerical scheme to efficiently solve boundary value problems involving the spectral fractional Laplacian. The approach is based on a reformulation of the problem posed on a…

Numerical Analysis · Mathematics 2018-08-17 Dominik Meidner , Johannes Pfefferer , Klemens Schürholz , Boris Vexler

We present Fiend - a simulation package for three-dimensional single-particle time-dependent Schr\"odinger equation for cylindrically symmetric systems. Fiend has been designed for the simulation of electron dynamics under inhomogeneus…

Computational Physics · Physics 2019-04-09 Janne Solanpää , Esa Räsänen

In this paper, we study a numerical method for the solution of partial differential equations on evolving surfaces. The numerical method is built on the stabilized trace finite element method (TraceFEM) for the spatial discretization and…

Numerical Analysis · Mathematics 2018-03-23 Christoph Lehrenfeld , Maxim A. Olshanskii , Xianmin Xu

This paper presents SunPy (version 0.5), a community-developed Python package for solar physics. Python, a free, cross-platform, general-purpose, high-level programming language, has seen widespread adoption among the scientific community,…

Algorithmic fairness has received considerable attention due to the failures of various predictive AI systems that have been found to be unfairly biased against subgroups of the population. Many approaches have been proposed to mitigate…

Machine Learning · Computer Science 2025-03-14 Agathe Fernandes Machado , Suzie Grondin , Philipp Ratz , Arthur Charpentier , François Hu

Nowadays interactive digital scientific environments have become an integral part of scientific computing in solving various scientific tasks in research, but also STEM education. We introduce SageMath or shortly Sage -- a free open…

Physics Education · Physics 2025-06-23 Dominik Borovský , Jozef Hanč , Martina Hančová

We find that with uniform mesh, the numerical schemes derived from finite element method can keep a preserved symplectic structure in one-dimensional case and a preserved multisymplectic structure in two-dimentional case in certain discrete…

High Energy Physics - Theory · Physics 2018-01-17 Han-Ying Guo , Xiao-mei Ji , Yu-Qi Li , Ke Wu

We present a Python module named PyCheb, to solve the ordinary differential equations by using spectral collocation method. PyCheb incorporates discretization using Chebyshev points, barycentric interpolation and iterate methods. With this…

Mathematical Software · Computer Science 2016-11-07 Shaohui Liu , Tianshi Wang , Youran Zhang

Background: As traditional coding tasks in education become increasingly vulnerable to the use of Generative AI, there is a critical need for authentic, project-based assessments that evaluate students' scientific inquiry. To address this…

Physics Education · Physics 2026-05-11 Sean Savage , Amir Bralin , Paul Hur , N. Sanjay Rebello

Three-dimensional rigid-body transforms, i.e. rotations and translations, are central to modern differentiable machine learning pipelines in robotics, vision, and simulation. However, numerically robust and mathematically correct…

Machine Learning · Computer Science 2025-11-27 Martin Schuck , Alexander von Rohr , Angela P. Schoellig