November 2023

Journal

Data-driven surrogate modeling of hPIC ion energy-angle distributions for high-dimensional sensitivity analysis of plasma parameters’ uncertainty

By:
Seleson, Pablo D; Mustafa, Mohammad; Curreli, Davide; Hauck, Cory D; Stoyanov, Miroslav K; Bernholdt, David E
Journal Name:
Computer Physics Communications
Page Number:
108436
Volume:
279
Issue Number:
NA
Publication Date:
November 9, 2023
View DOI Listing:
https://doi.org/10.1016/j.cpc.2022.108436

Abstract

We present a data-driven strategy for effective construction of a surrogate model in high-dimensional parameter space for the ion energy-angle distribution (IEAD) output of hPIC simulations of plasma-surface interactions. The methodology is based on a bin-by-bin least-squares fitting of the IEAD in the parameter space. The fitting is performed in a transformed coordinate system to normalize the IEAD, and it employs sparse grids for sampling the parameter space to overcome sampling challenges in high dimensions. The surrogate model is significantly cheaper computationally than direct hPIC simulations yet maintains high fidelity to them, providing a fast emulator for hPIC simulations. Sensitivity analysis based on the surrogate model is utilized to characterize the dependence of the ion impact angle and energy moments on the physical parameters.1