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High fidelity scientific simulations modeling physical phenomena typically require solving large linear systems of equations which result from discretization of a partial differential equation (PDE) by some numerical method. This step often…

Mathematical Software · Computer Science 2020-07-01 Mohammad Shafaet Islam , Qiqi Wang

Positive linear programs (LPs) model many graph and operations research problems. One can solve for a $(1+\epsilon)$-approximation for positive LPs, for any selected $\epsilon$, in polylogarithmic depth and near-linear work via variations…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-02-14 Caleb Ju , Serif Yesil , Mengyuan Sun , Chandra Chekuri , Edgar Solomonik

Sequential quadratic programming (SQP) is widely used in solving nonlinear optimization problem, with advantages of warm-starting solutions, as well as finding high-accurate solution and converging quadratically using second-order…

Optimization and Control · Mathematics 2023-10-23 Bowen Li , Michel Schanen , Kibaek Kim

Two-stage stochastic programming (2SP) offers a basic framework for modelling decision-making under uncertainty, yet scalability remains a challenge due to the computational complexity of recourse function evaluation. Existing…

Optimization and Control · Mathematics 2026-04-24 Yu Liu , Fabricio Oliveira , Jan Kronqvist

Understanding shock-solid interactions remains a central challenge in compressiblefluiddynamics. WepresentJAX-Shock: afully-differentiable,GPU-accelerated, high-order shock-capturing solver for efficient simulation of the compressible…

Fluid Dynamics · Physics 2026-01-09 Bo Zhang

We study the expressibility and learnability of convex optimization solution functions and their multi-layer architectural extension. The main results are: \emph{(1)} the class of solution functions of linear programming (LP) and quadratic…

Machine Learning · Computer Science 2022-12-05 Ming Jin , Vanshaj Khattar , Harshal Kaushik , Bilgehan Sel , Ruoxi Jia

Sequential social dilemmas pose a significant challenge in the field of multi-agent reinforcement learning (MARL), requiring environments that accurately reflect the tension between individual and collective interests. Previous benchmarks…

Machine Learning · Computer Science 2026-03-19 Zihao Guo , Shuqing Shi , Richard Willis , Tristan Tomilin , Joel Z. Leibo , Yali Du

We present a data-parallel software package for fitting Gaussian Approximation Potentials (GAPs) on multiple nodes using the ScaLAPACK library with MPI and OpenMP. Until now the maximum training set size for GAP models has been limited by…

Materials Science · Physics 2022-11-14 Sascha Klawohn , James R. Kermode , Albert P. Bartók

Primal-Dual Interior-Point methods are capable of solving constrained convex optimization problems to tight tolerances in a fast and robust manner. The derivatives of the primal-dual solution with respect to the problem matrices can be…

Optimization and Control · Mathematics 2024-06-21 Kevin Tracy , Zachary Manchester

We introduce fastabx, a high-performance Python library for building ABX discrimination tasks. ABX is a measure of the separation between generic categories of interest. It has been used extensively to evaluate phonetic discriminability in…

Computation and Language · Computer Science 2025-05-06 Maxime Poli , Emmanuel Chemla , Emmanuel Dupoux

With the emergence of Large Language Models (LLMs), there has been a significant improvement in the programming capabilities of models, attracting growing attention from researchers. Evaluating the programming capabilities of LLMs is…

The study of nonconvex minimax games has gained significant momentum in machine learning and decision science communities due to their fundamental connections to adversarial training scenarios. This work develops a primal-dual alternating…

Optimization and Control · Mathematics 2025-06-25 Huiling Zhang , Zi Xu , Yu-Hong Dai

Mixed integer nonlinear programming (MINLP) problems are encountered in modeling a physical/industrial process consisting both nonlinearity and discrete selective parameters. There are variety of algorithms for solving MINLP problems most…

Optimization and Control · Mathematics 2024-05-17 Negin Bagherpour , Mahdi Sharifzadeh

This paper introduces Helix, a distributed system for high-throughput, low-latency large language model (LLM) serving in heterogeneous GPU clusters. The key idea behind Helix is to formulate inference computation of LLMs over heterogeneous…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-03-07 Yixuan Mei , Yonghao Zhuang , Xupeng Miao , Juncheng Yang , Zhihao Jia , Rashmi Vinayak

Geometric computing with chain complexes allows for the computation of the whole chain of linear spaces and (co)boundary operators generated by a space decomposition into a cell complex. The space decomposition is stored and handled with…

Computational Geometry · Computer Science 2017-11-07 Francesco Furiani , Giulio Martella , Alberto Paoluzzi

MPJ Express is a messaging system that allows computational scientists to write and execute parallel Java applications on High Performance Computing (HPC) hardware. Despite its successful adoption in the Java HPC community, the MPJ Express…

Distributed, Parallel, and Cluster Computing · Computer Science 2014-08-28 Aleem Akhtar , Aamir Shafi , Mohsan Jameel

Mixed Binary Quadratic Programs (MBQPs) are an important and complex set of problems in combinatorial optimization. As solving large-scale combinatorial optimization problems is challenging, primal heuristics have been developed to quickly…

Machine Learning · Computer Science 2026-04-28 Weimin Huang , Natalie M. Isenberg , Ján Drgoňa , Draguna L Vrabie , Bistra Dilkina

The new generation of machine learning processors have evolved from multi-core and parallel architectures that were designed to efficiently implement matrix-vector-multiplications (MVMs). This is because at the fundamental level, neural…

Machine Learning · Computer Science 2020-11-06 Nazreen P. M. , Shantanu Chakrabartty , Chetan Singh Thakur

Recent advances in machine learning force fields (MLFF) have significantly extended the reach of atomistic simulations. Continuous progress in this field requires reliable reference datasets, accurate MLFF architectures, and efficient…

Chemical Physics · Physics 2025-10-24 Tobias Henkes , Shubham Sharma , Alexandre Tkatchenko , Mariana Rossi , Igor Poltavskyi

Quadratic programs (QPs) arise in various domains such as machine learning, finance, and control. Recently, learning-enhanced primal-dual hybrid gradient (PDHG) methods have shown great potential in addressing large-scale linear programs;…

Optimization and Control · Mathematics 2024-12-03 Linxin Yang , Bingheng Li , Tian Ding , Jianghua Wu , Akang Wang , Yuyi Wang , Jiliang Tang , Ruoyu Sun , Xiaodong Luo
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