zenodoopen
Nonunique fraction of Fock exchange for defects in two-dimensional materials
<p>This dataset contains the input and output files for the defect calculations as described in the paper "Nonunique fraction of Fock exchange for defects in two-dimensional materials".</p> <ol> <li>ws2.tar.gz: PBE and PBE0, monolayer WS<sub>2</sub></li> <li>ws2_bulk.tar.gz: PBE and PBE0, bulk WS<sub>2</sub></li> <li>ws2_bgw.tar.gz: G<sub>0</sub>W<sub>0</sub>, monolayer WS<sub>2</sub></li> </ol> <p> </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