Related papers: Composition of Transfer Matrices for Potentials wi…
We introduce a new method to construct, within inverse-scattering theory, an energy-independent separable potential capable of reproducing exactly both phase shift and absorption over a predefined energy range. The approach relies on the…
A formula is given for the propagation of errors during matrix inversion. An explicit calculation for a 2 by 2 matrix using both the formula and a Monte Carlo calculation are compared. A prescription is given to determine when a matrix with…
This work is part of an ongoing effort to build microscopically-driven nonlocal optical potentials easily tracktable in scattering codes. Based on the separable `$JvH$' structure proposed recently \cite{arellano_22}, where the potential can…
Sparse superposition codes were originally proposed as a capacity-achieving communication scheme over the gaussian channel, whose coding matrices were made of i.i.d. gaussian entries.We extend this coding scheme to more generic ensembles of…
We present the formalism and demonstrate the use of the overlapping muffin-tin approximation (OMTA). This fits a full potential to a superposition of spherically symmetric short-ranged potential wells plus a constant. For one-electron…
A complete and consistent inversion technique is proposed to derive an accurate interaction potential from an effective-range function for a given partial wave in the neutral case. First, the effective-range function is Taylor or Pad\'e…
We extend first-order multiconfigurational symmetry-adapted perturbation theory, SAPT(MC), [Hapka M. et al. JCTC, 2021, 17], to account for double-exchange effects, where up to two electron pairs are exchanged between interacting monomers.…
Parametric model order reduction by matrix interpolation allows for efficient prediction of the behavior of dynamic systems without requiring knowledge about the underlying parametric dependency. Within this approach, reduced models are…
A transfer matrix scaling technique is developed for randomly diluted systems, and applied to the site-diluted Ising model on a square lattice in two dimensions. For each allowed disorder configuration between two adjacent columns, the…
We study an inverse scattering problem at fixed energy for radial magnetic Schr{\"o}dinger operators on R^2 \ B(0, r\_0), where r\_0 is a positive and arbitrarily small radius. We assume that the magnetic potential A satisfies a gauge…
Analytical expressions for the exchange interaction between $J$-multiplets of interacting metallic centers are derived on the basis of a complete electronic model. A common belief that this interaction can be approximated by an isotropic…
Inverse scattering theory is extended to one-dimensional Schr\"odinger problems with near-boundary singularities of the form $v(z\to 0)\simeq -z^{-2}/4+v_{-1}z^{-1}$. Trace formulae relating the boundary value $v_0$ of the nonsingular part…
Given two matroids $\mathcal{M}_1 = (V, \mathcal{I}_1)$ and $\mathcal{M}_2 = (V, \mathcal{I}_2)$ over an $n$-element integer-weighted ground set $V$, the weighted matroid intersection problem aims to find a common independent set $S^{*} \in…
We study ordinal embedding relaxations in the realm of parameterized complexity. We prove the existence of a quadratic kernel for the {\sc Betweenness} problem parameterized above its tight lower bound, which is stated as follows. For a set…
We present the dispersion relation approach based on unitarity and analyticity to evaluate the two-photon exchange contribution to elastic electron-proton scattering. The leading elastic and first inelastic $\pi N$ intermediate state…
We consider the problem of recovering a smooth, compactly supported potential on R^3 from its backscattering data. We show that if two such potentials have the same backscattering data and the difference of the two potentials has controlled…
The microscopic theory of chemical reactions is based on transition state theory, where atoms or ions transfer classically over an energy barrier, as electrons maintain their ground state. Electron transfer is fundamentally different and…
The $\alpha$ inelastic scattering on $^{16}$O is investigated with the coupled-channel calculation using the $\alpha$-nucleus coupled-channel potentials, which are microscopically derived by folding the the Melbourne $g$-matrix $NN$…
Using the matrix product state (MPS) representation of tensor train decompositions, in this paper we propose a tensor completion algorithm which alternates over the matrices (tensors) in the MPS representation. This development is motivated…
An adaptive parametric reduced-order modeling method based on interpolating poles of reduced-order models is proposed in this paper. To guarantee correct interpolation, a pole-matching process is conducted to determine which poles of two…