zenodoopen
Data for "Workhorse minimally-empirical dispersion-corrected density functional, with tests for weakly-bound systems: r2 SCAN + rVV10"
<p>VASP inputs and outputs for the:</p> <ul> <li>Ar2 binding energy curve (Ar2_bpara.tar.gz)</li> <li>L28 set of layered-solid geometries and interlayer binding energies (L28.tar.gz)</li> <li>S22 set of interaction energies of weakly-bound complexes (S22.tar.gz)</li> </ul> <p>All POTCAR files have been replaced by "potcar.txt" files containing the title(s) of the POTCAR(s) needed to reproduce the calculations. A preprint is available from the arXiv:2204.11717 (<a href="https://arxiv.org/abs/2204.11717">link</a>).</p>
ShareScore
36/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 8
- Harmonization
- 4
- Access
- 16
- Reuse readiness
- 8
- Engagement
- 0