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The combined quantum electron-nuclear dynamics is often associated with the Born-Huang expansion of the molecular wave function and the appearance of nonadiabatic effects as a perturbation. On the other hand, native multicomponent…

Many solid mechanics problems on complex geometries are conventionally solved using discrete boundary methods. However, such an approach can be cumbersome for problems involving evolving domain boundaries due to the need to track boundaries…

Numerical Analysis · Mathematics 2025-06-06 Vinamra Agrawal , Brandon Runnels

Polynomial systems over the binary field have important applications, especially in symmetric and asymmetric cryptanalysis, multivariate-based post-quantum cryptography, coding theory, and computer algebra. In this work, we study the…

In this work, we propose a machine learning-based approach to address a specific aspect of the Quantum Marginal Problem: reconstructing a global density matrix compatible with a given set of quantum marginals. Our method integrates a…

Quantum Physics · Physics 2025-10-03 Daniel Uzcategui-Contreras , Antonio Guerra , Sebastian Niklitschek , Aldo Delgado

Quasi-Newton (QN) methods provide an efficient alternative to second-order methods for minimizing smooth unconstrained problems. While QN methods generally compose a Hessian estimate based on one secant interpolation per iteration,…

Optimization and Control · Mathematics 2025-04-11 Mokhwa Lee , Yifan Sun

We present a characteristic function method to calculate the probability density functions of the inclusive work in the adiabatic two-level quantum Markovian master equations. These systems are steered by some slowly varying parameters and…

Statistical Mechanics · Physics 2014-09-23 Fei Liu

Fitting geometric models onto outlier contaminated data is provably intractable. Many computer vision systems rely on random sampling heuristics to solve robust fitting, which do not provide optimality guarantees and error bounds. It is…

Computer Vision and Pattern Recognition · Computer Science 2022-06-28 Anh-Dzung Doan , Michele Sasdelli , David Suter , Tat-Jun Chin

Quantum electrodynamics (QED) provides a highly accurate description of phenomena involving the interaction of atoms with light. We argue that the quantum theory describing the interaction of cold atoms with a vibrating membrane--quantum…

Mesoscale and Nanoscale Physics · Physics 2017-05-29 Dennis P. Clougherty , Sanghita Sengupta

We present a novel approach to Bayesian inference and general Bayesian computation that is defined through a sequential decision loop. Our method defines a recursive partitioning of the sample space. It neither relies on gradients nor…

Machine Learning · Statistics 2021-06-10 Erik Bodin , Zhenwen Dai , Neill D. F. Campbell , Carl Henrik Ek

Many computer vision applications need to recover structure from imperfect measurements of the real world. The task is often solved by robustly fitting a geometric model onto noisy and outlier-contaminated data. However, recent theoretical…

Computer Vision and Pattern Recognition · Computer Science 2020-10-12 Tat-Jun Chin , David Suter , Shin-Fang Chng , James Quach

Numerically solving the Boltzmann kinetic equations with the small Knudsen number is challenging due to the stiff nonlinear collision term. A class of asymptotic preserving schemes was introduced in [6] to handle this kind of problems. The…

Numerical Analysis · Mathematics 2010-09-20 Francis Filbet , Jingwei Hu , Shi Jin

Two different approaches are formulated to analyze two-dimensional quantum models which are not amenable to standard separation of variables. Both methods are essentially based on supersymmetrical second order intertwining relations and…

Mathematical Physics · Physics 2012-04-13 Mikhail V. Ioffe

Conformal field theories have been extremely useful in our quest to understand physical phenomena in many different branches of physics, starting from condensed matter all the way up to high energy. Here we discuss applications of…

Quantum Physics · Physics 2021-12-14 Elias Kokkas , Aaron Bagheri , Zhenghan Wang , George Siopsis

Quantum many-body theory has witnessed tremendous progress in various fields, ranging from atomic and solid-state physics to quantum chemistry and nuclear structure. Due to the inherent computational burden linked to the ab initio treatment…

This work is divided in two parts. In the first three sections we review the meson physics phenomenology, highlighting the history of the pseudoscalar multiplet mass spectra research. Then we propose a new approach for the mass mixing…

High Energy Physics - Phenomenology · Physics 2025-11-17 R. L. P. G. Amaral , V. E. R. Lemes , O. S. Ventura , L. C. Q. Vilar

We discuss an approach for deriving robust posterior distributions from $M$-estimating functions using Approximate Bayesian Computation (ABC) methods. In particular, we use $M$-estimating functions to construct suitable summary statistics…

Methodology · Statistics 2019-06-13 Erlis Ruli , Nicola Sartori , Laura Ventura

We study an inverse design problem for the linear multiple fragmentation equation arising in particle dynamics. Our objective is to reconstruct an unknown initial size distribution that evolves, under a prescribed fragmentation law, into a…

Optimization and Control · Mathematics 2026-02-20 Arijit Das

We propose a scalable robust learning algorithm combining kernel smoothing and robust optimization. Our method is motivated by the convex analysis perspective of distributionally robust optimization based on probability metrics, such as the…

Machine Learning · Computer Science 2022-02-22 Jia-Jie Zhu , Christina Kouridi , Yassine Nemmour , Bernhard Schölkopf

One of the primary challenges in quantum chemistry is the accurate modeling of strong electron correlation. While multireference methods effectively capture such correlation, their steep scaling with system size prohibits their application…

We present a multiscale mixed finite element method for solving second order elliptic equations with general $L^{\infty}$-coefficients arising from flow in highly heterogeneous porous media. Our approach is based on a multiscale spectral…

Numerical Analysis · Mathematics 2024-04-05 Christian Alber , Chupeng Ma , Robert Scheichl