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The global many-electron wave function overlap matrix accounts for all effects beyond the Born-Oppenheimer approximation in the discrete variable local diabatic representation, a numerically exact framework for modeling nonadiabatic conical…

Chemical Physics · Physics 2025-01-10 Yujuan Xie , Bing Gu

We extend some basic results known for finite range operators to long range operators with off-diagonal decay. Namely, we prove an analogy of Sch'nol's theorem. We also establish the connection between the almost sure spectrum of long range…

Spectral Theory · Mathematics 2018-09-18 Rui Han

The computation of wave-energy distributions in the mid-to-high frequency regime can be reduced to ray-tracing calculations. Solving the ray-tracing problem in terms of an operator equation for the energy density leads to an inhomogeneous…

Chaotic Dynamics · Physics 2020-10-28 J Slipantschuk , M Richter , D J Chappell , G Tanner , W Just , O F Bandtlow

A new method to enclose the pseudospectrum via the numerical range of the inverse of a matrix or linear operator is presented. The method is applied to finite-dimensional discretizations of an operator on an infinite-dimensional Hilbert…

Spectral Theory · Mathematics 2020-11-06 Andreas Frommer , Birgit Jacob , Lukas Vorberg , Christian Wyss , Ian Zwaan

Transfer learning techniques aim to leverage information from multiple related datasets to enhance prediction quality against a target dataset. Such methods have been adopted in the context of high-dimensional sparse regression, and some…

Machine Learning · Statistics 2025-01-31 Koki Okajima , Tomoyuki Obuchi

A new technique for approximating eigenvalues and eigenvectors of a self-adjoint operator is presented. The method does not incur spectral pollution, uses trial spaces from the form domain, has a self-adjoint algorithm, and exhibits…

Spectral Theory · Mathematics 2014-03-28 Michael Strauss

Designing scalable estimation algorithms is a core challenge in modern statistics. Here we introduce a framework to address this challenge based on parallel approximants, which yields estimators with provable properties that operate on the…

Methodology · Statistics 2023-08-04 Aritra Chakravorty , William S. Cleveland , Patrick J. Wolfe

This paper offers a newly created integral approach for operators employing the orthogonal modified Laguerre polynomials and P\u{a}lt\u{a}nea basis. These operators approximate the functions over the interval $[0,\infty)$. Further, the…

Functional Analysis · Mathematics 2024-05-14 Kapil Kumar , Naokant Deo , Durvesh Kumar Verma

Orchestrating parametric fitting of multicomponent spectra at scale is an essential yet underappreciated task in high-throughput quantification of materials and chemical composition. To automate the annotation process for spectroscopic and…

Materials Science · Physics 2021-03-30 Rui Patrick Xian , Ralph Ernstorfer , Philipp Michael Pelz

Based on the work done by an electromagnetic field on an atomic or molecular electronic system, a general gauge invariant formulation of transient absorption spectroscopy is presented within the semi-classical approximation. Avoiding…

Data sites selected from modeling high-dimensional problems often appear scattered in non-paternalistic ways. Except for sporadic clustering at some spots, they become relatively far apart as the dimension of the ambient space grows. These…

Numerical Analysis · Mathematics 2021-09-28 Shao-Bo Lin , Xiangyu Chang , Xingping Sun

We present a novel projection-based model reduction framework for parametric linear time-invariant systems that allows interpolating the transfer function at a given frequency point along parameter-dependent curves as opposed to the…

Numerical Analysis · Mathematics 2021-04-05 Ion Victor Gosea , Serkan Gugercin , Benjamin Unger

There are now hundreds of publicly available supernova spectral time series. Radiative transfer modeling of this data gives insights into the physical properties of these explosions such as the composition, the density structure, or the…

High Energy Astrophysical Phenomena · Physics 2020-01-15 C. Vogl , W. E. Kerzendorf , S. A. Sim , U. M. Noebauer , S. Lietzau , W. Hillebrandt

The half-line Dirac operators with $L^2$-potentials can be characterized by their spectral data. It is known that the spectral correspondence is a homeomorphism: close potentials give rise to close spectral data and vice versa. We prove the…

Spectral Theory · Mathematics 2025-05-02 Roman Bessonov , Pavel Gubkin

Koopman operator theory enables linear analysis of nonlinear dynamical systems by lifting their evolution to infinite-dimensional function spaces. However, finite-dimensional approximations of Koopman and transfer (Frobenius--Perron)…

Dynamical Systems · Mathematics 2025-07-24 April Herwig , Matthew J. Colbrook , Oliver Junge , Péter Koltai , Julia Slipantschuk

We started from computer experiments with simple one-dimensional ergodic dynamical systems called interval exchange transformations. Correlators in these systems decay as a power of time. In the simplest non-trivial case the exponent is…

High Energy Physics - Theory · Physics 2008-02-03 M. Kontsevich , A. Zorich

We establish spectral convergence results of approximations of unbounded non-selfadjoint linear operators with compact resolvents by operators that converge in generalized strong resolvent sense. The aim is to establish general assumptions…

Spectral Theory · Mathematics 2016-04-27 Sabine Bögli

Simulating quantum systems with their environments often requires non-unitary operations, and mapping these to quantum devices often involves expensive dilations or prohibitive measurement costs to achieve desired precisions. Building on…

Quantum Physics · Physics 2025-02-03 Aman Mehta , Scott E. Smart , Joseph Peetz , David A. Mazziotti , Prineha Narang

Let $\bigl\{X_k\bigr\}_{k \in \mathbb{Z}} \in \mathbb{L}^2(\mathcal{T})$ be a stationary process with associated lag operators ${\boldsymbol{\cal C}}_h$. Uniform asymptotic expansions of the corresponding empirical eigenvalues and…

Statistics Theory · Mathematics 2016-02-16 Moritz Jirak

To approximate solutions of a linear differential equation, we project, via trigonometric interpolation, its solution space onto a finite-dimensional space of trigonometric polynomials and construct a matrix representation of the…

Numerical Analysis · Mathematics 2011-08-30 Oksana Bihun , Austin Bren , Michael Dyrud , Kristin Heysse
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