Published September 20, 2023 | Version v1
Dataset Open

Data for the manuscript "Improved Initialisation of Optimal Path Calculations Using Stepwise Traversal over the Image Dependent Pair Potential Surface"

  • 1. Science Institute and Faculty of Physical Sciences, University of Iceland, 107 Reykjavík, Iceland
  • 2. Institut für Physikalische und Theoretische Chemie, Fakultät für Chemie und Pharmazie, Julius-Maximilians-Universität Würzburg, D-97074, Germany

Description

Data of all initial and minimum energy paths presented.

Files

Data.zip

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Additional details

Funding

ReaxPro – Software Platform for Multiscale Modelling of Reactive Materials and Processes 814416
European Commission