How to cite this Dataset
Lovelock, Kevin R. J. and Hunt, Patricia A. (2025): Dataset supporting the article 'Accurate prediction of ionic liquid density-of-states from low-cost calculations'. University of Reading. Dataset. https://doi.org/10.17864/1947.001412
Description
This compressed file is supplementary to the article cited in the 'Related publication' section below. Its contents are the output files of all the ionic liquids studied computationally. These computational files will allow you to replicate the Density Functional Theory (DFT) calculations using Gaussian 16 shown in the article.
| Resource Type: | Dataset |
|---|---|
| Creators: | Lovelock, Kevin R. J.  ORCID: https://orcid.org/0000-0003-1431-269X and Hunt, Patricia A. ORCID: https://orcid.org/0000-0001-9144-1853 |
| Rights-holders: | University of Reading, Victoria University of New Zealand |
| Data Publisher: | University of Reading |
| Publication Year: | 2025 |
| Data last accessed: | 1 April 2025 |
| DOI: | https://doi.org/10.17864/1947.001412 |
| Metadata Record URL: | https://researchdata.reading.ac.uk/id/eprint/1412 |
| Organisational units: | Life Sciences > School of Chemistry, Food and Pharmacy > Department of Chemistry |
| Participating Organisations: | University of Reading, Victoria University of New Zealand |
| Rights: | |
| Data Availability: | OPEN |
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