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The Kernel Polynomial Method (KPM) is a well-established scheme in quantum physics and quantum chemistry to determine the eigenvalue density and spectral properties of large sparse matrices. In this work we demonstrate the high optimization…

Computational Engineering, Finance, and Science · Computer Science 2015-07-30 Moritz Kreutzer , Georg Hager , Gerhard Wellein , Andreas Pieper , Andreas Alvermann , Holger Fehske

Controlling the deformation of flexible objects is challenging due to their non-linear dynamics and high-dimensional configuration space. This work presents a differentiable Material Point Method (MPM) simulator targeted at control…

Robotics · Computer Science 2025-12-16 Diego Bolliger , Gabriele Fadini , Markus Bambach , Alisa Rupenyan

The Material Point Method (MPM) is a numerical technique that combines a fixed Eulerian background grid and Lagrangian point masses to simulate materials which undergo large deformations. Within the original MPM, discontinuous gradients of…

Numerical Analysis · Mathematics 2019-07-22 Pascal de Koster , Roel Tielen , Elizaveta Wobbes , Matthias Möller

Mesh-free Lagrangian methods are widely used for simulating fluids, solids, and their complex interactions due to their ability to handle large deformations and topological changes. These physics simulators, however, require substantial…

Machine Learning · Computer Science 2025-02-25 Omer Rochman Sharabi , Sacha Lewin , Gilles Louppe

In this work we consider the hybrid Data-Driven Computational Mechanics (DDCM) approach, in which a smooth constitutive manifold is reconstructed to obtain a well-behaved nonlinear optimization problem (NLP) rather than the much harder…

Numerical Analysis · Mathematics 2023-11-08 Cristian Guillermo Gebhardt , Senta Lange , Marc Christian Steinbach

This study focuses on solving the numerical challenges of imposing absorbing boundary conditions for dynamic simulations in the material point method (MPM). To attenuate elastic waves leaving the computational domain, the current work…

Geophysics · Physics 2025-01-24 Jun Kurima , Bodhinanda Chandra , Kenichi Soga

We present a novel convex formulation that weakly couples the Material Point Method (MPM) with rigid body dynamics through frictional contact, optimized for efficient GPU parallelization. Our approach features an asynchronous time-splitting…

Robotics · Computer Science 2025-07-08 Chang Yu , Wenxin Du , Zeshun Zong , Alejandro Castro , Chenfanfu Jiang , Xuchen Han

Classical control of cyber-physical systems used to rely on basic linear controllers. These controllers provided a safe and robust behavior but lack the ability to perform more complex controls such as aggressive maneuvering or performing…

Logic in Computer Science · Computer Science 2019-04-22 Guillaume Davy , Eric Féron , Pierre-Loïc Garoche , Didier Henrion

The interior-point method (IPM) has become the workhorse method for nonlinear programming. The performance of IPM is directly related to the linear solver employed to factorize the Karush--Kuhn--Tucker (KKT) system at each iteration of the…

Optimization and Control · Mathematics 2022-03-23 François Pacaud , Sungho Shin , Michel Schanen , Daniel Adrian Maldonado , Mihai Anitescu

Classical Distributed Model Predictive Control (DiMPC) requires multiple iterations to achieve convergence, leading to high computational and communication burdens. This work focuses on the improvement of an iteration-free distributed MPC…

Optimization and Control · Mathematics 2026-04-03 Parth R. Brahmbhatt , Hari S. Ganesh , Styliani Avraamidou

The Mixup method (Zhang et al. 2018), which uses linearly interpolated data, has emerged as an effective data augmentation tool to improve generalization performance and the robustness to adversarial examples. The motivation is to curtail…

Machine Learning · Computer Science 2020-12-25 Minjin Kim , Young-geun Kim , Dongha Kim , Yongdai Kim , Myunghee Cho Paik

The material point method (MPM) has been increasingly used for the simulation of large deformation processes in fluid-infiltrated porous materials. For undrained poromechanical problems, however, standard MPMs are numerically unstable…

Numerical Analysis · Mathematics 2020-02-27 Yidong Zhao , Jinhyun Choo

The Maximum Mean Discrepancy (MMD) is a cornerstone statistic for nonparametric two-sample testing, but its test power is dictated entirely by the chosen kernel. Because any fixed kernel inherently fails to distinguish certain…

Machine Learning · Statistics 2026-05-11 Yijin Ni , Xiaoming Huo

Explicit machine learning-based model predictive control (explicit ML-MPC) has been developed to reduce the real-time computational demands of traditional ML-MPC. However, the evaluation of candidate control actions in explicit ML-MPC can…

Optimization and Control · Mathematics 2024-08-14 Wenlong Wang , Haohao Zhang , Yujia Wang , Yuhe Tian , Zhe Wu

This work proposes a model-reduction approach for the material point method on nonlinear manifolds. Our technique approximates the $\textit{kinematics}$ by approximating the deformation map using an implicit neural representation that…

Machine Learning · Computer Science 2023-02-13 Peter Yichen Chen , Maurizio M. Chiaramonte , Eitan Grinspun , Kevin Carlberg

Accurate frictional contact is critical in simulating the assembly of rod-like structures in the practical world, such as knots, hairs, flagella, and more. Due to their high geometric nonlinearity and elasticity, rod-on-rod contact remains…

Graphics · Computer Science 2024-02-21 Dezhong Tong , Andrew Choi , Jungseock Joo , M. Khalid Jawed

Much recent work in bioinformatics has focused on the inference of various types of biological networks, representing gene regulation, metabolic processes, protein-protein interactions, etc. A common setting involves inferring network edges…

Quantitative Methods · Quantitative Biology 2007-05-23 Jean-Philippe Vert , Jian Qiu , William Stafford Noble

Meshfree methods, including the reproducing kernel particle method (RKPM), have been widely used within the computational mechanics community to model physical phenomena in materials undergoing large deformations or extreme topology…

Numerical Analysis · Mathematics 2025-06-19 Jennifer E. Fromm , John A. Evans , J. S. Chen

The material point method (MPM), a hybrid Lagrangian-Eulerian particle method, is increasingly used to simulate large-deformation and history-dependent behavior of geomaterials. While explicit time integration dominates current MPM…

Computational Engineering, Finance, and Science · Computer Science 2025-12-30 Yidong Zhao , Xuan Li , Chenfanfu Jiang , Jinhyun Choo

Numerous molecular systems, including solutions, proteins, and composite materials, can be modeled using mixed-resolution representations, of which the quantum mechanics/molecular mechanics (QM/MM) approach has become the most widely used.…

Chemical Physics · Physics 2018-01-17 Anton V. Sinitskiy , Gregory A. Voth