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Although many programs have been published for fully numerical Hartree--Fock (HF) or density functional (DF) calculations on atoms, we are not aware of any that support hybrid DFs, which are popular within the quantum chemistry community…

Chemical Physics · Physics 2019-08-19 Susi Lehtola

We want to propose a new discretization ansatz for the second order Hessian complex exploiting benefits of isogeometric analysis, namely the possibility of high-order convergence and smoothness of test functions. Although our approach is…

Numerical Analysis · Mathematics 2021-09-14 Jeremias Arf , Bernd Simeon

Complexes and cohomology, traditionally central to topology, have emerged as fundamental tools across applied mathematics and the sciences. This survey explores their roles in diverse areas, from partial differential equations and continuum…

Numerical Analysis · Mathematics 2025-10-21 Kaibo Hu

A robust and fast solver for the fractional differential equation (FDEs) involving the Riesz fractional derivative is developed using an adaptive finite element method on non-uniform meshes. It is based on the utilization of hierarchical…

Numerical Analysis · Mathematics 2017-10-11 Xuan Zhao , Xiaozhe Hu , Wei Cai , George Em Karniadakis

We show that the elasticity Hilbert complex with mixed boundary conditions on bounded strong Lipschitz domains is closed and compact. The crucial results are compact embeddings which follow by abstract arguments using functional analysis…

Analysis of PDEs · Mathematics 2023-07-19 Dirk Pauly , Michael Schomburg

Complexes of discrete distributional differential forms are introduced into finite element exterior calculus. Thus we generalize a notion of Braess and Sch\"oberl, originally studied for a posteriori error estimation. We construct…

Numerical Analysis · Mathematics 2015-09-09 Martin Werner Licht

In this paper, we introduce a new finite expression method (FEX) to solve high-dimensional partial integro-differential equations (PIDEs). This approach builds upon the original FEX and its inherent advantages with new advances: 1) A novel…

Numerical Analysis · Mathematics 2025-06-19 Gareth Hardwick , Senwei Liang , Haizhao Yang

This article surveys research on the application of compatible finite element methods to large scale atmosphere and ocean simulation. Compatible finite element methods extend Arakawa's C-grid finite difference scheme to the finite element…

Numerical Analysis · Mathematics 2023-03-14 Colin J. Cotter

In this paper we investigate homologically finite-dimensional objects in the derived category of a given small dg-enhanced triangulated category. Using these we define reflexivity, hfd-closedness, and the Gorenstein property for…

Algebraic Geometry · Mathematics 2024-12-02 Alexander Kuznetsov , Evgeny Shinder

We present a unified hard-constraint framework for solving geometrically complex PDEs with neural networks, where the most commonly used Dirichlet, Neumann, and Robin boundary conditions (BCs) are considered. Specifically, we first…

Machine Learning · Computer Science 2023-06-06 Songming Liu , Zhongkai Hao , Chengyang Ying , Hang Su , Jun Zhu , Ze Cheng

We extend the finite element method introduced by Lakkis and Pryer [2011] to approximate the solution of second order elliptic problems in nonvariational form to incorporate the discontinuous Galerkin (DG) framework. This is done by viewing…

Numerical Analysis · Mathematics 2013-04-09 Andreas Dedner , Tristan Pryer

An optimal and robust low-order nonconforming finite element method is developed for the strain gradient elasticity (SGE) model in arbitrary dimension. An $H^2$-nonconforming quadratic vector-valued finite element in arbitrary dimension is…

Numerical Analysis · Mathematics 2025-12-30 Jianguo Huang , Xuehai Huang , Zheqian Tang

We construct finite element de~Rham complexes of higher and possibly non-uniform polynomial order in finite element exterior calculus (FEEC). Starting from the finite element differential complex of lowest-order, known as the complex of…

Numerical Analysis · Mathematics 2023-10-17 Martin Werner Licht

We study eigenvalue problems for the de Rham complex on varying three dimensional domains. Our analysis includes the Helmholtz equation as well as the Maxwell system with mixed boundary conditions and non-constant coefficients. We provide…

Analysis of PDEs · Mathematics 2025-02-18 Pier Domenico Lamberti , Dirk Pauly , Michele Zaccaron

We present a continuous finite element method for some examples of fully nonlinear elliptic equation. A key tool is the discretisation proposed in Lakkis & Pryer (2011, SISC) allowing us to work directly on the strong form of a linear PDE.…

Numerical Analysis · Mathematics 2015-03-19 Omar Lakkis , Tristan Pryer

The tensor product of two differential forms of degree $p$ and $q$ is a multilinear form that is alternating in its first $p$ arguments and alternating in its last $q$ arguments. These forms, which are known as double forms or…

Numerical Analysis · Mathematics 2025-05-26 Yakov Berchenko-Kogan , Evan S. Gawlik

We propose one finite element method for both second order linear uniformly elliptic PDE in non-divergence form and the uniformly elliptic Hamilton-Jacobi-Bellman (HJB) equation. For both linear elliptic PDE in non-divergence form and the…

Numerical Analysis · Mathematics 2026-04-28 Weifeng Qiu

We present new finite elements for solving the Riesz maps of the de Rham complex on triangular and tetrahedral meshes at high order. The finite elements discretize the same spaces as usual, but with different basis functions, so that the…

Numerical Analysis · Mathematics 2026-03-18 Pablo D. Brubeck , Patrick E. Farrell , Robert C. Kirby , Charles Parker

We present new rectangular mixed finite elements for linear elasticity. The approach is based on a modification of the Hellinger-Reissner functional in which the symmetry of the stress field is enforced weakly through the introduction of a…

Numerical Analysis · Mathematics 2011-03-04 Gerard Awanou

Fourth-order differential equations play an important role in many applications in science and engineering. In this paper, we present a three-field mixed finite-element formulation for fourth-order problems, with a focus on the effective…

Numerical Analysis · Mathematics 2022-10-13 Patrick E. Farrell , Abdalaziz Hamdan , Scott P. MacLachlan