pyFDRT : An open‐source Python tool for Fourier‐transform analysis of the distribution of relaxation times in electrochemical impedance spectra

Abstract Electrochemical impedance spectroscopy (EIS) is widely used to characterize electrochemical systems. However, interpreting overlapping relaxation processes typically requires prior knowledge of the system under investigation. Although distribution of relaxation times (DRT) analysis deconvolutes these processes, results remain sensitive to user‐defined choices including the discretization basis, regularization strength, and peak identification. We present pyFDRT, an open‐source Python package for Fourier‐transform DRT analysis that fully automates these parameter selections. The workflow first estimates the DRT using Fourier‐transform deconvolution without requiring discretization or regularization parameters. Subsequently, this initial estimate is refined using non‐negative least squares with automated Tikhonov regularization. The number of relaxation processes is then determined using analytic ZARC kernels (resistor in parallel with a constant phase element). Benchmark evaluations against existing Python‐based DRT tools demonstrate that pyFDRT consistently recovers the correct number of relaxation processes from theoretical spectra. Additionally, Warburg open behavior arising from diffusion processes can be identified automatically or specified by the user during DRT calculations.

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Publication Details

Journal
Bulletin of the Korean Chemical Society
Published
2026-10-13
DOI
https://doi.org/10.1002/bkcs.70232
Primary Topic
Electrochemical Analysis and Applications
Type
article
Field-Weighted Citation Impact
0.00

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article

pyFDRT : An open‐source Python tool for Fourier‐transform analysis of the distribution of relaxation times in electrochemical impedance spectra

Chung‐Yul Yoo, Jaeku Park, Jeongjin John Kim
Bulletin of the Korean Chemical Society
Electrochemical Analysis and Applications
article

pyFDRT : An open‐source Python tool for Fourier‐transform analysis of the distribution of relaxation times in electrochemical impedance spectra

Chung‐Yul Yoo, Jaeku Park, Jeongjin John Kim
article en

Abstract

Abstract Electrochemical impedance spectroscopy (EIS) is widely used to characterize electrochemical systems. However, interpreting overlapping relaxation processes typically requires prior knowledge of the system under investigation. Although distribution of relaxation times (DRT) analysis deconvolutes these processes, results remain sensitive to user‐defined choices including the discretization basis, regularization strength, and peak identification. We present pyFDRT, an open‐source Python package for Fourier‐transform DRT analysis that fully automates these parameter selections. The workflow first estimates the DRT using Fourier‐transform deconvolution without requiring discretization or regularization parameters. Subsequently, this initial estimate is refined using non‐negative least squares with automated Tikhonov regularization. The number of relaxation processes is then determined using analytic ZARC kernels (resistor in parallel with a constant phase element). Benchmark evaluations against existing Python‐based DRT tools demonstrate that pyFDRT consistently recovers the correct number of relaxation processes from theoretical spectra. Additionally, Warburg open behavior arising from diffusion processes can be identified automatically or specified by the user during DRT calculations.

Bulletin of the Korean Chemical Society
Pohang University of Science and Technology (KR), Ajou University (KR)
National Research Foundation of Korea, Ministry of Science and ICT, South Korea
Openalex Percentile: Top 30%
Electrochemical Analysis and Applications
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