The Landau-DeGennes Q-model of uniaxial nematic liquid crystals seeks a rank-one

traceless tensor Q that minimizes a Frank-type energy plus a double well potential

that confines the eigenvalues of Q to lie between -1/2 and 1. We propose a finite

element method (FEM) which preserves this basic structure and satisfies a discrete

form of the fundamental energy estimates. We prove that the discrete problem Gamma

converges to the continuous one as the meshsize tends to zero, and propose a discrete

gradient flow to compute discrete minimizers. Numerical experiments confirm the ability

of the scheme to approximate configurations with half-integer defects, and to deal with

colloidal and electric field effects. This work, joint with J.P. Borthagaray and S.

Walker, builds on our previous work for the Ericksen's model which we review briefly.

As parallel computers approach Exascale (10^18 floating point operations per second), processor failure and data corruption are of increasing concern. Numerical linear algebra solvers are at the heart of many scientific and engineering applications, and with the increasing failure rates, they may fail to compute a solution or produce an incorrect solution. It is therefore crucial to develop novel parallel linear algebra solvers capable of providing correct solutions on unreliable computing systems. The common way to mitigate failures in high performance computing systems consists of periodically saving data onto a reliable storage device such as a remote disk. But considering the increasing failure rate and the ever-growing volume of data involved in numerical simulations, the state-of-the-art fault-tolerant strategies are becoming time consuming, therefore unsuitable for large-scale simulations. In this talk, we will present a  novel class of fault-tolerant algorithms that do not require any additional resources. The key idea is to leverage the knowledge of numerical properties of solvers involved in a simulation to regenerate lost data due to system failures. We will also share the lessons learned and report on the numerical properties and the performance of the new resilience algorithms.

One of the major steps in the adaptive finite element methods (AFEM) is the adaptive selection of the next partition. The process is usually governed by a strategy based on carefully chosen local error indicators and aims at convergence results with optimal rates. One can formally relate the refinement of the partitions with growing an oriented graph or a tree. Then each node of the tree/graph corresponds to a cell of a partition and the approximation of a function on adaptive partitions can be expressed trough the local errors related to the cell, i.e., the node. The total approximation error is then calculated as the sum of the errors on the leaves (the terminal nodes) of the tree/graph and the problem of finding an optimal error for a given budget of nodes is known as tree approximation. Establishing a near-best tree approximation result is a key ingredient in proving optimal convergence rates for AFEM.

The classical tree approximation problems are usually related to the so-called h-adaptive approximation in which the improvements a due to reducing the size of the cells in the partition. This talk will consider also an extension of this framework to hp-adaptive approximation allowing different polynomial spaces to be used for the local approximations at different cells while maintaining the near-optimality in terms of the combined number of degrees of freedom used in the approximation.

The problem of conformity of the resulting partition will be discussed as well. Typically in AFEM, certain elements of the current partition are marked and subdivided together with some additional ones to maintain desired properties of the partition like conformity. This strategy is often described as “mark → subdivide → complete”. The process is very well understood for triangulations received via newest vertex bisection procedure. In particular, it is proven that the number of elements in the final partition is limited by constant times the number of marked cells. This hints at the possibility to design a marking procedure that is limited only to cells of the partition whose subdivision will result in a conforming partition and therefore no completion step would be necessary. This talk will present such a strategy together with theoretical results about its near-optimal performance.

In this talk, I am going to give an introduction to operator preconditioning as a general and robust strategy to precondition linear systems arising from Galerkin discretization of PDEs or Boundary Integral Equations. Then, in order to illustrate the applicability of this preconditioning technique, I will discuss the simple case of weakly singular and hypersingular integral equations, arising from exterior Dirichlet and Neumann BVPs for the Laplacian in 3D. Finally, I will show how we can also tackle operators with a more difficult structure, like the electric field integral equation (EFIE) on screens, which models the scattering of time-harmonic electromagnetic waves at perfectly conducting bounded infinitely thin objects, like patch antennas in 3D.

We present a novel approach to the solution of time-dependent PDEs via the so-called monolithic or all-at-once formulation.

This approach will be explained for simple parabolic problems and its utility in the context of PDE constrained optimization problems will be elucidated.

The underlying linear algebra includes circulant matrix approximations of Toeplitz-structured matrices and allows for effective parallel implementation. Simple computational results will be shown for the heat equation and the wave equation which indicate the potential as a parallel-in-time method.

This is joint work with Elle McDonald (CSIRO, Australia), Jennifer Pestana (Strathclyde University, UK) and Anthony Goddard (Durham University, UK)