Published June 12, 2019
| Version v1
Dataset
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Supporting Information for the Journal Article "The electrostatic potential as a descriptor for the protonation propensity in automated exploration of reaction mechanisms"
Authors/Creators
- 1. Laboratory of Physical Chemistry, ETH Zurich
Description
This dataset contains the supporting information published together with the article "The electrostatic potential as a descriptor for the protonation propensity in automated exploration of reaction mechanisms" (Faraday Discuss., 2019, 220, 443).
Files
faraday_discuss_2019_220_443_si.zip
Files
(174.4 kB)
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md5:d705f9ed8139b1f319972e67daac994d
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Additional details
Related works
- Is supplement to
- Journal article: 10.1039/C9FD00061E (DOI)