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The ground state energy of a many-electron system can be approximated by an variational approach in which the total energy of the system is minimized with respect to one and two-body reduced density matrices (RDM) instead of many-electron…

Optimization and Control · Mathematics 2017-09-01 Yongfeng Li , Zaiwen Wen , Chao Yang , Yaxiang Yuan

In this article we propose a novel nonstationary iterated Tikhonov (NIT) type method for obtaining stable approximate solutions to ill-posed operator equations modeled by linear operators acting between Hilbert spaces. Geometrical…

Numerical Analysis · Mathematics 2020-11-12 R. Boiger , A. Leitao , B. F. Svaiter

Newton's method is a fundamental technique in optimization with quadratic convergence within a neighborhood around the optimum. However reaching this neighborhood is often slow and dominates the computational costs. We exploit two…

Machine Learning · Computer Science 2016-05-24 Hadi Daneshmand , Aurelien Lucchi , Thomas Hofmann

Tikhonov regularization with square-norm penalty for linear forward operators has been studied extensively in the literature. However, the results on convergence theory are based on technical proofs and difficult to interpret. It is also…

Numerical Analysis · Mathematics 2021-07-07 Daniel Gerth

Sub-sampling is applied to simulated $T_1$-$D$ NMR signals and its influence on inversion performance is evaluated. For this different levels of sub-sampling were employed ranging from the fully sampled signal down to only less than two…

Chemical Physics · Physics 2024-01-02 Julian B. B. Beckmann , Mick D. Mantle , Andrew J. Sederman , Lynn F. Gladden

In this paper we propose a new class of iterative regularization methods for solving ill-posed linear operator equations. The prototype of these iterative regularization methods is in the form of second order evolution equation with a…

Numerical Analysis · Mathematics 2020-06-24 Rongfang Gong , B. Hofmann , Ye Zhang

The recently developed data-driven eigenmatrix method shows very promising reconstruction accuracy in sparse recovery for a wide range of kernel functions and random sample locations. However, its current implementation can lead to…

Numerical Analysis · Mathematics 2024-05-15 Koung Hee Leem , Jun Liu , George Pelekanos

Data assisted reconstruction algorithms, incorporating trained neural networks, are a novel paradigm for solving inverse problems. One approach is to first apply a classical reconstruction method and then apply a neural network to improve…

Numerical Analysis · Mathematics 2020-03-26 Yoeri E. Boink , Markus Haltmeier , Sean Holman , Johannes Schwab

This paper is a contribution to the reproducibility challenge in the field of machine learning, specifically addressing the issue of certifying the robustness of neural networks (NNs) against adversarial perturbations. The proposed Double…

Machine Learning · Computer Science 2023-06-28 Aryan Gupta , Sarthak Gupta , Abhay Kumar , Harsh Dugar

In this work, we describe a new approach that uses deep neural networks (DNN) to obtain regularization parameters for solving inverse problems. We consider a supervised learning approach, where a network is trained to approximate the…

Numerical Analysis · Mathematics 2021-04-15 Babak Maboudi Afkham , Julianne Chung , Matthias Chung

We study a semismooth Newton-type method for the nearest doubly stochastic matrix problem where both differentiability and nonsingularity of the Jacobian can fail. The optimality conditions for this problem are formulated as a system of…

Optimization and Control · Mathematics 2021-07-21 Hao Hu , Haesol Im , Xinxin Li , Henry Wolkowicz

Optimization on Riemannian manifolds widely arises in eigenvalue computation, density functional theory, Bose-Einstein condensates, low rank nearest correlation, image registration, and signal processing, etc. We propose an adaptive…

Optimization and Control · Mathematics 2017-08-08 Jiang Hu , Andre Milzarek , Zaiwen Wen , Yaxiang Yuan

We introduce and investigate the asymptotic behaviour of the trajectories of a second order dynamical system with Tikhonov regularization for solving a monotone equation with single valued, monotone and continuous operator acting on a real…

Optimization and Control · Mathematics 2024-11-27 Ernö Robert Csetnek , Szilárd Csaba László

We introduce new multilevel methods for solving large-scale unconstrained optimization problems. Specifically, the philosophy of multilevel methods is applied to Newton-type methods that regularize the Newton sub-problem using second order…

Optimization and Control · Mathematics 2024-07-16 Nick Tsipinakis , Panos Parpas

Total least squares (TLS) is an effective method for solving linear equations with the situations, when noise is not just in observation matrices but also in mapping matrices. Moreover, the Tikhonov regularization is widely used in plenty…

Numerical Analysis · Mathematics 2022-11-14 F. Han , Y. Wei , P. Xie

In this paper, we investigate iterative methods that are based on sampling of the data for computing Tikhonov-regularized solutions. We focus on very large inverse problems where access to the entire data set is not possible all at once…

Numerical Analysis · Mathematics 2018-12-18 J. Tanner Slagel , Julianne Chung , Matthias Chung , David Kozak , Luis Tenorio

In this paper we consider the composite self-concordant (CSC) minimization problem, which minimizes the sum of a self-concordant function $f$ and a (possibly nonsmooth) proper closed convex function $g$. The CSC minimization is the…

Optimization and Control · Mathematics 2016-07-04 Zhaosong Lu

This paper is concerned with the introduction of Tikhonov regularization into least squares approximation scheme on $[-1,1]$ by orthonormal polynomials, in order to handle noisy data. This scheme includes interpolation and…

Numerical Analysis · Mathematics 2021-08-31 Congpei An , Hao-Ning Wu

In this paper, we propose new methods to efficiently solve convex optimization problems encountered in sparse estimation, which include a new quasi-Newton method that avoids computing the Hessian matrix and improves efficiency, and we prove…

Optimization and Control · Mathematics 2023-09-06 Ryosuke Shimmura , Joe Suzuki

The truncated singular value decomposition may be used to find the solution of linear discrete ill-posed problems in conjunction with Tikhonov regularization and requires the estimation of a regularization parameter that balances between…

Numerical Analysis · Mathematics 2022-08-16 Rosemary A. Renaut , Anthony W. Helmstetter , Saeed Vatankhah