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Ehrenfest dynamics is a useful approximation for ab initio mixed quantum-classical molecular dynamics that can treat electronically nonadiabatic effects. Although a severe approximation to the exact solution of the molecular time-dependent Schrödinger equa ...
This thesis focuses on the numerical analysis of partial differential equations (PDEs) with an emphasis on first and second-order fully nonlinear PDEs. The main goal is the design of numerical methods to solve a variety of equations such as orthogonal maps ...
Two-level domain decomposition methods are very powerful techniques for the efficient numerical solution of partial differential equations (PDEs). A two-level domain decomposition method requires two main components: a one-level preconditioner (or its corr ...
In the context of cardiac electrophysiology, we propose a novel computational approach to highlight and explain the long-debated mechanisms behind atrial fibrillation (AF) and to reliably numerically predict its induction and sustainment. A key role is pla ...
In this work, we present, analyze, and implement a class of Multi-Level Markov chain Monte Carlo (ML-MCMC) algorithms based on independent Metropolis-Hastings proposals for Bayesian inverse problems. In this context, the likelihood function involves solvin ...
The Dirichlet-Neumann (DN) method has been extensively studied for linear partial differential equations, while little attention has been devoted to the nonlinear case. In this paper, we analyze the DN method both as a nonlinear iterative method and as a p ...
This work is concerned with approximating a trivariate function defined on a tensor-product domain via function evaluations. Combining tensorized Chebyshev interpolation with a Tucker decomposition of low multilinear rank yields function approximations tha ...
Hydraulic fracturing is a technique often used in the oil and gas industry to enhance the production of wells in low-permeability reservoirs. It consists of fluid injection at a sufficiently large injection rate to create and propagate tensile fractures in ...
A reduced basis method based on a physics-informed machine learning framework is developed for efficient reduced-order modeling of parametrized partial differential equations (PDEs). A feedforward neural network is used to approximate the mapping from the ...
This paper presents neural network regression models for predicting the nonlinear static and linearized dynamic reaction forces of spiral grooved gas journal bearings. The partial differential equations (PDEs) are sampled, based on a full factorial and ran ...
