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We propose a simple iterative algorithm to construct the optimal multi-configuration approximation of an $N$-fermion wave function. That is, $M\geq N $ single-particle orbitals are sought iteratively so that the projection of the given wave…
The invariant polytope algorithm was a breakthrough in the joint spectral radius computation, allowing to find the exact value of the joint spectral radius for most matrix families~\cite{GP2013,GP2016}. This algorithm found many…
We show how to construct highly symmetric algorithms for matrix multiplication. In particular, we consider algorithms which decompose the matrix multiplication tensor into a sum of rank-1 tensors, where the decomposition itself consists of…
The N-representability problem consists in determining whether, for a given p-body matrix, there exists at least one N-body density matrix from which the p-body matrix can be obtained by contraction, that is, if the given matrix is a p-body…
This paper introduces a new computational framework to derive electromagnetic field derivatives with respect to multiple design parameters up to any order with the Finite-Difference Time-Domain (FDTD) technique. Specifically, only one FDTD…
In this paper we explore avenues for improving the reliability of dimensionality reduction methods such as Non-Negative Matrix Factorization (NMF) as interpretive exploratory data analysis tools. We first explore the difficulties of the…
This paper presents a hybrid trajectory optimization method designed to generate collision-free, smooth trajectories for autonomous mobile robots. By combining sampling-based Model Predictive Path Integral (MPPI) control with gradient-based…
The dominant theme of this thesis is the construction of matrix representations of finite solvable groups using a suitable system of generators. For a finite solvable group $G$ of order $N = p_{1}p_{2}\dots p_{n}$, where $p_{i}$'s are…
This paper deals with the problem of constructing superregular matrices that lead to MDP convolutional codes. These matrices are a type of lower block triangular Toeplitz matrices with the property that all the square submatrices that can…
Positive semidefinite matrix factorization (PSDMF) expresses each entry of a nonnegative matrix as the inner product of two positive semidefinite (psd) matrices. When all these psd matrices are constrained to be diagonal, this model is…
We explore new approaches for finding matrix multiplication algorithms in the commutative setting by adapting the flip graph technique: a method previously shown to be effective for discovering fast algorithms in the non-commutative case.…
In methods like geminal-based approaches or coupled cluster that are solved using the projected Schr\"odinger equation, direct computation of the 2-electron reduced density matrix (2-RDM) is impractical and one falls back to a 2-RDM based…
We investigate the ideal and incompressible magnetohydrodynamic (MHD) equations in three space dimensions for the development of potentially singular structures. The methodology consists in implementing the four-fold symmetries of the…
A zero-one matrix is a matrix with entries from $\{0, 1\}$. We study monoids containing only such matrices. A finite set of zero-one matrices generating such a monoid can be seen as the matrix representation of an unambiguous finite…
The multiple scattering method T-matrix (MSTMM) can be used to solve the electromagnetic response of systems consisting of many compact scatterers, retaining a good level of accuracy while using relatively few degrees of freedom, largely…
The notion of mixed representations of quivers can be derived from ordinary quiver representations by considering the dual action of groups on "vertex" vector spaces together with the usual action. A generating system for the algebra of…
Reduced density matrices are central to describing observables in many-body quantum systems. In electronic structure theory, the two-particle reduced density matrix (2-RDM) suffices to determine the energy and other key properties. Recent…
Bayesian inverse problems often involve sampling posterior distributions on infinite-dimensional function spaces. Traditional Markov chain Monte Carlo (MCMC) algorithms are characterized by deteriorating mixing times upon mesh-refinement,…
A code of length $n$ is said to be (combinatorially) $(\rho,L)$-list decodable if the Hamming ball of radius $\rho n$ around any vector in the ambient space does not contain more than $L$ codewords. We study a recently introduced class of…
Over a field of characteristic 0, the algebra of invariants of several $n\times n$ matrices under simultaneous conjugation by $GL_n$ is generated by traces of products of generic matrices. In this paper we have found, in terms of…