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This work introduces a neural operator based surrogate modeling framework for neutron transport computation. Two architectures, the Deep Operator Network (DeepONet) and the Fourier Neural Operator (FNO), were trained for fixed source…

Computational Physics · Physics 2026-02-19 Md Hossain Sahadath , Qiyun Cheng , Shaowu Pan , Wei Ji

The security-constrained optimal power flow (SCOPF) is fundamental in power systems and connects the automatic primary response (APR) of synchronized generators with the short-term schedule. Every day, the SCOPF problem is repeatedly solved…

Optimization and Control · Mathematics 2020-07-15 Alexandre Velloso , Pascal Van Hentenryck

In this paper, we present decomposition techniques for solving large-scale instances of the security-constrained optimal power flow (SCOPF) problem with primary response. Specifically, under each contingency state, we require that the nodal…

Optimization and Control · Mathematics 2019-10-10 Alexandre Velloso , Pascal Van Hentenryck , Emma S. Johnson

With the development of artificial intelligence, simulation-based optimization problems, which present a significant challenge in the process systems engineering community, are increasingly being addressed with the surrogate-based…

Optimization and Control · Mathematics 2025-01-30 Zixuan Zhang , Xiaowei Song , Yujiao Zeng , Jie Li , Yaling Nie , Min Zhu , Jianhua Chen , Linmin Wang , Xin Xiao

Neural PDE surrogates can improve the cost-accuracy tradeoff of classical solvers, but often generalize poorly to new initial conditions and accumulate errors over time. Physical and symmetry constraints have shown promise in closing this…

Machine Learning · Computer Science 2025-06-09 Yunfei Huang , David S. Greenberg

Estimating consistent parameters of a structured state-space representation requires a reliable initialization when the vector of parameters is computed by using a gradient-based algorithm. In the eponymous companion paper accepted for…

Systems and Control · Computer Science 2014-06-04 Guillaume Mercère , José Ramos , Olivier Prot

Within integrated tokamak plasma modelling, turbulent transport codes are typically the computational bottleneck limiting their routine use outside of post-discharge analysis. Neural network (NN) surrogates have been used to accelerate…

Prediction+optimization is a common real-world paradigm where we have to predict problem parameters before solving the optimization problem. However, the criteria by which the prediction model is trained are often inconsistent with the goal…

Machine Learning · Computer Science 2021-11-23 Kai Yan , Jie Yan , Chuan Luo , Liting Chen , Qingwei Lin , Dongmei Zhang

Graph theory provides a convenient framework for modeling and solving structured optimization problems. Under this framework, the modeler can arrange/assemble the components of an optimization model (variables, constraints, objective…

Optimization and Control · Mathematics 2026-05-11 David L Cole , Sungho Shin , Victor Zavala

Neural networks have become very popular in surrogate modeling because of their ability to characterize arbitrary, high dimensional functions in a data driven fashion. This paper advocates for the training of surrogates that are consistent…

Machine Learning · Computer Science 2022-06-08 Rushil Anirudh , Jayaraman J. Thiagarajan , Peer-Timo Bremer , Brian K. Spears

Global optimization of large-scale, complex systems such as multi-physics black-box simulations and real-world industrial systems is important but challenging. This work presents a novel Surrogate-Based Optimization framework based on…

Machine Learning · Computer Science 2026-01-13 Maaz Ahmad , Iftekhar A. Karimi

Physics simulations like computational fluid dynamics (CFD) are a computational bottleneck in computer-aided design (CAD) optimization processes. To overcome this bottleneck, one requires either an optimization framework that is highly…

Machine Learning · Computer Science 2024-08-29 Harsh Vardhan , David Hyde , Umesh Timalsina , Peter Volgyesi , Janos Sztipanovits

Constrained optimization of the parameters of a simulator plays a crucial role in a design process. These problems become challenging when the simulator is stochastic, computationally expensive, and the parameter space is high-dimensional.…

Optimization and Control · Mathematics 2023-11-28 Atul Agrawal , Kislaya Ravi , Phaedon-Stelios Koutsourelakis , Hans-Joachim Bungartz

When a black-box optimization objective can only be evaluated with costly or noisy measurements, most standard optimization algorithms are unsuited to find the optimal solution. Specialized algorithms that deal with exactly this situation…

Machine Learning · Computer Science 2021-06-11 Laurens Bliek , Sicco Verwer , Mathijs de Weerdt

Many combinatorial optimization problems can be phrased in the language of constraint satisfaction problems. We introduce a graph neural network architecture for solving such optimization problems. The architecture is generic; it works for…

Artificial Intelligence · Computer Science 2020-02-12 Jan Toenshoff , Martin Ritzert , Hinrikus Wolf , Martin Grohe

We study the problem of learning neural classifiers in a neurosymbolic setting where the hidden gold labels of input instances must satisfy a logical formula. Learning in this setting proceeds by first computing (a subset of) the possible…

Machine Learning · Computer Science 2026-02-10 Aaditya Naik , Efthymia Tsamoura , Shibo Jin , Mayur Naik , Dan Roth

Numerical simulations in climate, chemistry, or astrophysics are computationally too expensive for uncertainty quantification or parameter-exploration at high-resolution. Reduced-order or surrogate models are multiple orders of magnitude…

Machine Learning · Computer Science 2022-07-26 Björn Lütjens , Catherine H. Crawford , Campbell D Watson , Christopher Hill , Dava Newman

Three pseudospectral algorithms are described (Euler, leapfrog and trapez) for solving numerically the time dependent nonlinear Schroedinger equation in one, two or three dimensions. Numerical stability regions in the parameter space are…

Computational Physics · Physics 2007-05-23 A. A. Skorupski

This paper proposes a machine-learning-based solution approach for solving multi-horizon stochastic programs. The approach embeds a deep learning neural network into a multi-horizon stochastic program to approximate the recourse operational…

Optimization and Control · Mathematics 2025-12-03 Hongyu Zhang , Gabriele Sormani , Enza Messina , Alan King , Francesca Maggioni

Simulation models are widely used in practice to facilitate decision-making in a complex, dynamic and stochastic environment. But they are computationally expensive to execute and optimize, due to lack of analytical tractability. Simulation…

Optimization and Control · Mathematics 2021-06-14 L. Jeff Hong , Xiaowei Zhang