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We present a GPU-accelerated version of the real-space SPARC electronic structure code for performing Kohn-Sham density functional theory calculations within the local density and generalized gradient approximations. In particular, we…

Computational Physics · Physics 2023-06-14 Abhiraj Sharma , Alfredo Metere , Phanish Suryanarayana , Lucas Erlandson , Edmond Chow , John E. Pask

This paper contributes to the exploration of a recently introduced computational paradigm known as second-order flows, which are characterized by novel dissipative hyperbolic partial differential equations extending accelerated gradient…

Numerical Analysis · Mathematics 2025-05-13 Haifan Chen , Guozhi Dong , José A. Iglesias , Wei Liu , Ziqing Xie

We introduce an extended discontinuous Galerkin discretization of hyperbolic-parabolic problems on multidimensional semi-infinite domains. Building on previous work on the one-dimensional case, we split the strip-shaped computational domain…

Numerical Analysis · Mathematics 2023-09-01 Federico Vismara , Tommaso Benacchio

We introduce new methods for the numerical solution of general Hamiltonian boundary value problems. The main feature of the new formulae is to produce numerical solutions along which the energy is precisely conserved, as is the case with…

Numerical Analysis · Mathematics 2014-11-26 P. Amodio , L. Brugnano , F. Iavernaro

Centered numerical fluxes can be constructed for compressible Euler equations which preserve kinetic energy in the semi-discrete finite volume scheme. The essential feature is that the momentum flux should be of the form $f^m_\jph =…

Numerical Analysis · Computer Science 2016-08-24 Praveen Chandrashekar

The fully nonlinear and weakly dispersive Green-Naghdi model for shallow water waves of large amplitude is studied. The original model is first recast under a new formulation more suitable for numerical resolution. An hybrid finite volume…

Numerical Analysis · Mathematics 2011-03-04 Philippe Bonneton , Florent Chazel , David Lannes , Fabien Marche , Marion Tissier

In parallel simulation, convergence and parallelism are often seen as inherently conflicting objectives. Improved parallelism typically entails lighter local computation and weaker coupling, which unavoidably slow the global convergence.…

Graphics · Computer Science 2025-06-10 Lei Lan , Zixuan Lu , Chun Yuan , Weiwei Xu , Hao Su , Huamin Wang , Chenfanfu Jiang , Yin Yang

Adaptive finite elements combined with geometric multigrid solvers are one of the most efficient numerical methods for problems such as the instationary Navier-Stokes equations. Yet despite their efficiency, computations remain expensive…

Numerical Analysis · Mathematics 2025-12-23 Manuel Liebchen , Robert Jendersie , Utku Kaya , Christian Lessig , Thomas Richter

We present an energy conservative, quadrature based model reduction framework for the compressible Euler equations of Lagrangian hydrodynamics. Building on a finite element discretization of the governing equations, we develop reduced…

Numerical Analysis · Mathematics 2026-03-06 Chris Vales , Siu Wun Cheung , Dylan M. Copeland , Youngsoo Choi

A framework for numerical evaluation of entropy-conservative volume fluxes in gas flows with internal energies is developed, for use with high-order discretization methods. The novelty of the approach lies in the ability to use arbitrary…

Fluid Dynamics · Physics 2024-10-18 Georgii Oblapenko , Manuel Torrilhon

We present the numerical methods and GPU-accelerated implementation underlying a Total Lagrangian finite element framework for finite-deformation flexible multibody dynamics, introduced in the companion paper [1]. The framework supports…

Computational Engineering, Finance, and Science · Computer Science 2026-05-04 Zhenhao Zhou , Ruochun Zhang , Ganesh Arivoli , Dan Negrut

In [Cou15] a multiplier technique, going back to Leray and G{\aa}rding for scalar hyperbolic partial differential equations, has been extended to the context of finite difference schemes for evolutionary problems. The key point of the…

Numerical Analysis · Mathematics 2020-09-25 Jean-François Coulombel

Traditionally, classical numerical schemes have been employed to solve partial differential equations (PDEs) using computational methods. Recently, neural network-based methods have emerged. Despite these advancements, neural network-based…

Numerical Analysis · Mathematics 2024-05-14 Taeyoung Kim , Myungjoo Kang

We design an arbitrary high-order accurate nodal discontinuous Galerkin spectral element approximation for the nonlinear two dimensional shallow water equations with non-constant, possibly discontinuous, bathymetry on unstructured, possibly…

Numerical Analysis · Mathematics 2016-06-23 Niklas Wintermeyer , Andrew R. Winters , Gregor J. Gassner , David A. Kopriva

The entropy conservative, curvilinear, nonconforming, p-refinement algorithm for hyperbolic conservation laws of Del Rey Fernandez et al. (2019), is extended from the compressible Euler equations to the compressible Navier-Stokes equations.…

We present a constrained formulation of Dedner et al's hyperbolic/parabolic divergence cleaning scheme for enforcing the \nabla\dot B = 0 constraint in Smoothed Particle Magnetohydrodynamics (SPMHD) simulations. The constraint we impose is…

Instrumentation and Methods for Astrophysics · Physics 2012-08-17 Terrence S. Tricco , Daniel J. Price

We present a neural network-based method for learning scalar hyperbolic conservation laws. Our method replaces the traditional numerical flux in finite volume schemes with a trainable neural network while preserving the conservative…

We present an efficient implementation for running three-dimensional numerical simulations of fluid-structure interaction problems on single GPUs, based on Nvidia CUDA through Numba and Python. The incompressible flow around moving bodies…

Fluid Dynamics · Physics 2024-12-05 M. Guerrero-Hurtado , J. M. Catalán , M. Moriche , A. Gonzalo , O. Flores

Kinetic simulations are computationally intensive due to six-dimensional phase space discretization. Many kinetic spectral solvers use the asymmetrically weighted Hermite expansion due to its conservation and fluid-kinetic coupling…

In this work we consider Runge-Kutta discontinuous Galerkin methods (RKDG) for the solution of hyperbolic equations enabling high order discretization in space and time. We aim at an efficient implementation of DG for Euler equations on…

Numerical Analysis · Mathematics 2021-04-12 M. Siebenborn , V. Schulz , S. Schmidt
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