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We demonstrate scaffolding of plasmonic nanoparticles by topological defects induced by colloidal microspheres to match their surface boundary conditions with a uniform far-field alignment in a liquid crystal host. Displacing energetically…

Vibrational spectroscopy is a key technique to elucidate microscopic structure and dynamics. Without the aid of theoretical approaches, it is however, often difficult to understand such spectra at a microscopic level. Ab initio molecular…

Chemical Physics · Physics 2023-03-14 Philipp Schienbein

The error of smoothed particle hydrodynamics (SPH) using kernel for particle-based approximation mainly comes from smoothing and integration errors. The choice of kernels has a significant impact on the numerical accuracy, stability and…

Computational Physics · Physics 2023-09-06 Zhentong Wang , Bo Zhang , Oskar J. Haidn , Xiangyu Hu

A surrogate model is developed to predict the convective heat transfer coefficient of liquid sodium (Na) flow within rectangular miniature heat sinks. Initially, kernel-based machine learning techniques and shallow neural network are…

Machine Learning · Computer Science 2025-09-09 Reza Pirayeshshirazinezhad

Spherical convolutional neural networks (Spherical CNNs) learn nonlinear representations from 3D data by exploiting the data structure and have shown promising performance in shape analysis, object classification, and planning among others.…

Machine Learning · Computer Science 2021-04-06 Zhan Gao , Fernando Gama , Alejandro Ribeiro

A method for correcting smearing effects using machine learning technique is presented. Compared to the standard deconvolution approaches in high energy particle physics, the method can use more than one reconstructed variable to predict…

Data Analysis, Statistics and Probability · Physics 2020-01-30 Bora Işıldak , Alper Hayreter , Aidan R. Wiederhold

We introduce the {\it diffusion $K$-means} clustering method on Riemannian submanifolds, which maximizes the within-cluster connectedness based on the diffusion distance. The diffusion $K$-means constructs a random walk on the similarity…

Statistics Theory · Mathematics 2020-03-17 Xiaohui Chen , Yun Yang

Predicting the quantum dynamics of promising solid-state and molecular quantum technology candidates remains a formidable challenge. Yet, accessing these dynamics is key to understanding and controlling decoherence mechanisms -- a…

Chemical Physics · Physics 2026-04-10 Tianchu Li , Pranay Venkatesh , Nanako Shitara , Andrés Montoya-Castillo

This paper presents a new clustering algorithm for symmetric positive semi-definite (SPSD) matrices, called K-Tensors. The method identifies structured subsets of the SPSD cone characterized by common principal component (CPC)…

Machine Learning · Computer Science 2025-09-03 Hanchao Zhang , Xiaomeng Ju , Baoyi Shi , Lingsong Meng , Thaddeus Tarpey

The Kinetic Monte Carlo (KMC) method has become an important tool for examination of phenomena like surface diffusion and thin film growth because of its ability to carry out simulations for time scales that are relevant to experiments. But…

Materials Science · Physics 2007-05-23 Talat S. Rahman , Abdelkader Kara , Altaf Karim , Oleg Trushin

We present a rotation-equivariant unsupervised learning framework for the sparse deconvolution of non-negative scalar fields defined on the unit sphere. Spherical signals with multiple peaks naturally arise in Diffusion MRI (dMRI), where…

Image and Video Processing · Electrical Eng. & Systems 2021-02-19 Axel Elaldi , Neel Dey , Heejong Kim , Guido Gerig

Directional data consist of observations distributed on a (hyper)sphere, and appear in many applied fields, such as astronomy, ecology, and environmental science. This paper studies both statistical and computational problems of kernel…

Machine Learning · Statistics 2021-10-18 Yikun Zhang , Yen-Chi Chen

We present a practical guide to Smoothed Particle Hydrodynamics (\SPH) and its application to astrophysical problems. Although remarkably robust, \SPH\ must be used with care if the results are to be meaningful since the accuracy of \SPH\…

Astrophysics · Physics 2007-05-23 T. J. Martin , F. R. Pearce , P. A. Thomas

In this paper we present results from a series of hydrodynamical tests aimed at validating the performance of a smoothed particle hydrodynamics (SPH) formulation in which gradients are derived from an integral approach. We specifically…

Instrumentation and Methods for Astrophysics · Physics 2016-11-09 R. Valdarnini

Point clouds are unstructured and unordered in the embedded 3D space. In order to produce consistent responses under different permutation layouts, most existing methods aggregate local spatial points through maximum or summation operation.…

Computer Vision and Pattern Recognition · Computer Science 2020-09-04 Yuan Fang , Chunyan Xu , Zhen Cui , Yuan Zong , Jian Yang

We present a new algorithm for clustering points in R^n. The key property of the algorithm is that it is affine-invariant, i.e., it produces the same partition for any affine transformation of the input. It has strong guarantees when the…

Machine Learning · Computer Science 2008-08-04 S. Charles Brubaker , Santosh S. Vempala

We present a novel method for particle splitting in smoothed particle hydrodynamics simulations. Our method utilizes the Voronoi diagram for a given particle set to determine the position of fine daughter particles. We perform several test…

Instrumentation and Methods for Astrophysics · Physics 2015-06-02 Gen Chiaki , Naoki Yoshida

Small-scale features of shallow water flow obtained from direct numerical simulation (DNS) with two different computational codes for the shallow water equations are gathered offline and subsequently employed with the aim of constructing a…

Fluid Dynamics · Physics 2022-02-24 Sagy Ephrati , Erwin Luesink , Golo Wimmer , Paolo Cifani , Bernard Geurts

Point clouds are versatile representations of 3D objects and have found widespread application in science and engineering. Many successful deep-learning models have been proposed that use them as input. The domain of chemical and materials…

Computer Vision and Pattern Recognition · Computer Science 2024-02-07 Sergey N. Pozdnyakov , Michele Ceriotti

We summarize the ideas that led to the Adaptive Smoothed Particle Hydrodynamics (ASPH) algorithm, with anisotropic smoothing and shock-tracking. We then identify a serious new problem for SPH simulations with shocks and radiative cooling…

Astrophysics · Physics 2007-05-23 Hugo Martel , Paul R. Shapiro