ePSproc: CH3I wavefn test run, orb 29 ioinzation (sigma bonding, A1), 1 - 60 eV
CH3I wavefn test run, orb 29 ioinzation (sigma bonding, A1), 1 - 60 eV - photoionization calculations with ePolyScat (ePS) + ePSproc.<br><br>*Web version*: <a href="https://phockett.github.io/ePSdata/CH3I_1-60eV/CH3I_1-60eV_orb29_A1.html">https://phockett.github.io/ePSdata/CH3I_1-60eV/CH3I_1-60eV_orb29_A1.html</a><br><br>For more details of the calculations, see readme.txt, or: <ul><li><a href="https://phockett.github.io/ePSdata/about.html">About ePSdata</a></li><li><a href="http://epsproc.readthedocs.io/en/latest/about.html">About ePSproc</a></li><li><a href="http://www.chem.tamu.edu/rgroup/lucchese/ePolyScat.E3.manual/manual.html">About ePS</a></li></ul>
ShareScore
40/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 8
- Harmonization
- 4
- Access
- 20
- Reuse readiness
- 8
- Engagement
- 0