Data for "Beyond Magic Numbers: Atomic Scale Equilibrium Nanoparticle Shapes for Any Size"
<p>This record contains <a href="https://wiki.fysik.dtu.dk/ase/ase/db/db.html">ASE databases</a> in sqlite format that contain the minimum energy structures of nanoparticles of Ag, Au, Cu, and Pd as determined in the paper "<em>Beyond Magic Numbers: Atomic Scale Equilibrium Nanoparticle Shapes for Any Size</em>", Rahm and Erhart, Nano Letters <strong>17</strong>, 5775 (2017); <a href="http://doi.org/10.1021/acs.nanolett.7b02761">doi: 10.1021/acs.nanolett.7b02761</a></p> <p>The <code>access-database.py</code> script included in this record demonstrates how to access the databases. It requires the <a href="https://wiki.fysik.dtu.dk/ase/">ASE package</a> to be installed.</p>
ShareScore
40/100
Overall dataset sharing score
Score breakdown
These five areas show where the dataset supports — or may limit — practical reuse.
- Stewardship
- 4
- Harmonization
- 4
- Access
- 20
- Reuse readiness
- 8
- Engagement
- 4