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Paper · arXiv

A Physics-Informed Neural Network with a Modified Lorentzian Activation for Nonlocal Gradient-Flow Equations in Dynamic Density Functional Theory

We develop a physics-informed neural network (PINN) framework for nonlocal partial differential equations arising in dynamic density functional theory (DDFT). Such equations are challenging for standard PINN methods because they involve nonlinearities, nonlocal interaction terms, and an underlying gradient-flow structure, often leading to slow convergence and difficult optimization. We adapt the PINN methodology to DDFT gradient-flow equations and introduce two computational components: a modified Lorentzian activation function that behaves approximately linearly for small inputs and decays toward zero as the input magnitude increases, and a precomputed discrete operator for evaluating th...

AuthorsDimitrios Gourzoulidis, Soumaya Elkantassi, Serafim Kalliadasis
Primary categorymath.NA
Published24 June 2026
Last updated at source24 June 2026
math.NAcs.LG
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