zenodoopen
Two- and one-photon absorption spectra of aqueous thiocyanate anion highlight the role of symmetry in the condensed phase
<p>The snapshots.zip contains the snapshots extracted from QM/MM AIMD simulations used in 2PA calculations</p><p>The 2pa_inp_out.zip contains the 2PA calculation input and output files for each of the snapshots. </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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