Supplementary data and microkinetic model for 'Key Role of CO Coverage for Chain Growth in Co-Based Fischer-Tropsch Synthesis'
<p>This repository contains:</p> <ol> <li>The DFT data (energies, frequencies and structures) of all important intermediates of the microkinetic model constructed for the publication ‘Key Role of CO Coverage for Chain Growth in Co-Based Fischer-Tropsch Synthesis’.</li> <li>Input files for the high CO coverage microkinetic model in Chemkin.</li> <li>(update 2025-06-19) Input files for the high CO coverage microkinetic model in Chemkin with CO2 activation (sim2.zip).</li> </ol> <p>DOI: <u>10.1021/acscatal.5c03024</u> and <u>10.1021/acscatal.3c04844</u></p>
ShareScore
32/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 4
- Harmonization
- 4
- Access
- 16
- Reuse readiness
- 8
- Engagement
- 0
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