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We present a local and transferable machine learning approach capable of predicting the real-space density response of both molecules and periodic systems to external homogeneous electric fields. The new method, SALTER, builds on the…

Chemical Physics · Physics 2023-07-19 Alan M Lewis , Paolo Lazzaroni , Mariana Rossi

We introduce a fully spectral learning framework that eliminates traditional neural layers by operating entirely in the wavelet domain. The model applies learnable nonlinear transformations, including soft-thresholding and gain-phase…

Machine Learning · Computer Science 2025-07-29 Andrew Kiruluta

The use of machine learning is becoming increasingly common in computational materials science. To build effective models of the chemistry of materials, useful machine-based representations of atoms and their compounds are required. We…

Materials Science · Physics 2021-08-02 Luis M. Antunes , Ricardo Grau-Crespo , Keith T. Butler

Embedding molecular symmetries into machine-learning models is key for efficient learning of chemico-physical scalar properties, but little evidence on how to extend the same strategy to tensorial quantities exists. Here we formulate a…

Materials Science · Physics 2022-04-27 Vu Ha Anh Nguyen , Alessandro Lunghi

Machine learning techniques are essential tools to compute efficient, yet accurate, force fields for atomistic simulations. This approach has recently been extended to incorporate quantum computational methods, making use of variational…

Harmonic generation in the scattered fields produced by a dielectric sphere coated with a time-varying conductive shell is studied using a Mie theory approach hybridized with conversion matrix methods. Analytic results are derived for plane…

Optics · Physics 2022-09-21 Kurt Schab , Bradley Shirley , K. C. Kerby-Patel

Motivated by applications to acoustic imaging, the present work establishes a framework to analyze scattering for the one-dimensional wave, Helmholtz, Schr\"odinger and Riccati equations that allows for coefficients which are more singular…

Analysis of PDEs · Mathematics 2022-02-28 Peter C. Gibson

In many machine learning tasks it is desirable that a model's prediction transforms in an equivariant way under transformations of its input. Convolutional neural networks (CNNs) implement translational equivariance by construction; for…

Machine Learning · Computer Science 2018-03-20 Maurice Weiler , Fred A. Hamprecht , Martin Storath

Inverse wave scattering aims at determining the properties of an object using data on how the object scatters incoming waves. In order to collect information, sensors are put in different locations to send and receive waves from each other.…

Machine Learning · Computer Science 2026-01-22 Hanyang Jiang , Yuehaw Khoo , Haizhao Yang

Scattering is an important phenomenon which is observed in systems ranging from the micro- to macroscale. In the context of nuclear reaction theory the Heidelberg approach was proposed and later demonstrated to be applicable to many chaotic…

Machine learning (ML) has become a versatile tool for analyzing anomalous diffusion trajectories, yet most existing pipelines are trained on large collections of simulated data. In contrast, experimental trajectories, such as those from…

Biological Physics · Physics 2025-12-10 Gongyi Wang , Yu Zhang , Zihan Huang

Machine learning (ML) facilitates rapid channel modeling for 5G and beyond wireless communication systems. Many existing ML techniques utilize a city map to construct the radio map; however, an updated city map may not always be available.…

Signal Processing · Electrical Eng. & Systems 2024-03-04 Wangqian Chen , Junting Chen

We apply the Poynting theorem to the scattering of monochromatic electromagnetic planes waves with normal incidence to the interface of two different media. We write this energy conservation theorem to introduce a natural definition of the…

Classical Physics · Physics 2008-10-30 V. Dominguez-Rocha , C. Zagoya , M. Martinez-Mares

We analyze energy decay for deep convolutional neural networks employed as feature extractors, including Mallat's wavelet scattering transform. For time-frequency scattering transforms based on Gabor filters, previous work has established…

Functional Analysis · Mathematics 2026-01-06 Hartmut Führ , Max Getter

Symmetry transformations induce invariances which are frequently described with deep latent variable models. In many complex domains, such as the chemical space, invariances can be observed, yet the corresponding symmetry transformation…

Machine Learning · Computer Science 2020-10-23 Mario Wieser , Sonali Parbhoo , Aleksander Wieczorek , Volker Roth

A Statistic Vectorial Complex Ray Model (SVCRM) is proposed for the scattering of a plane wave by a non-spherical dielectric particle in three dimensions. This method counts the complex amplitudes of all rays arriving in a tiny box in the…

Optics · Physics 2024-03-21 Ruiping Yang , Bing Wei , Claude Rozé , Saïd Idlahcen , Kuan Ffang Ren

Scattering phase shifts of a meson-meson system in staggered 3-dimensional lattice QED are computed. The main task of the simulation is to obtain a discrete set of two-body energy levels. These are extracted from a 4-point time correlation…

High Energy Physics - Lattice · Physics 2009-10-22 H. R. Fiebig , R. M. Woloshyn

This chapter is dedicated to recent developments in the field of wavelet analysis for scattered data. We introduce the concept of samplets, which are signed measures of wavelet type and may be defined on sets of arbitrarily distributed data…

Numerical Analysis · Mathematics 2025-03-25 Helmut Harbrecht , Michael Multerer

This paper introduces a Deep Scattering network that utilizes Dual-Tree complex wavelets to extract translation invariant representations from an input signal. The computationally efficient Dual-Tree wavelets decompose the input signal into…

Computer Vision and Pattern Recognition · Computer Science 2017-02-14 Amarjot Singh , Nick Kingsbury

Neutron and X-ray scattering represent two state-of-the-art materials characterization techniques that measure materials' structural and dynamical properties with high precision. These techniques play critical roles in understanding a wide…

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