cff-version: 1.2.0
abstract: "<p>Included files:</p><ol><li>Chemical and molecular biological dataset from Kranzioch et al. (2015) to implement Enzyme-based kinetics for reductive dechlorination (file format *.csv);</li><li>Results of the batch and scenario-based numerical models (file format *.csv);</li><li>Jupyter notebook file for visualizing simulation results (file format *.ipynb);</li><li>PHREEQC input files&nbsp;of the batch and scenario-based numerical models created with Notepad++.</li></ol>"
authors:
  - family-names: Di Curzio
    given-names: Diego
    orcid: "https://orcid.org/0000-0002-2465-1014"
  - family-names: Laureni
    given-names: Michele
    orcid: "https://orcid.org/0000-0001-6248-8679"
  - family-names: Broholm
    given-names: Mette M.
    orcid: "https://orcid.org/0000-0002-8443-5110"
  - family-names: Weissbrodt
    given-names: David G.
    orcid: "https://orcid.org/0000-0002-6313-1652"
  - family-names: van Breukelen
    given-names: Boris M.
    orcid: "https://orcid.org/0000-0001-9642-1077"
title: "Data underlying the publication: Integrating enzyme-based kinetics in reactive transport models to simulate spatiotemporal dynamics of biomarkers during chlorinated ethene degradation"
keywords:
version: 1
identifiers:
  - type: doi
    value: 10.4121/96405c3a-aad9-4904-b6ea-5aabe6280e15.v1
license: CC0
date-released: 2024-10-28