QMC Raw Data for "Friedel oscillations in one-dimensional 4He"
<p>Raw path integral quantum Monte Carlo data associted with "Friedel oscillations in one-dimensional 4He". Connected github repository with associated analysis scripts can be found at <a title="Github repo" href="https://github.com/DelMaestroGroup/papers-code-HourglassNanopores">https://github.com/DelMaestroGroup/papers-code-HourglassNanopores.</a> Path integral software is available: <a title="PIMC" href="https://github.com/DelMaestroGroup/pimc">https://github.com/DelMaestroGroup/pimc</a></p> <h2><strong>Contents</strong></h2> <p><code>dR_eq_{δR}.tar.gz</code> includes raw QMC data where <code>{δR} = {0.0,2.0,3.0.4.0} Å</code> is the perturbed radius of the hourglass. All simulations include a perturbation with width <code>w = 3.0 Å</code>. Temperature is fixed at <code>T = 2.0 K</code>. </p> <p>Each <code>.tar.gz</code> contains <code>log</code> and <code>estimator</code> files for the simulations described in the associated paper. </p> <p><code>U_hourglass.npz</code>: generated xy mesh for potential plotting. </p> <p><code>gce-position-dR_eq_{δR}.npz</code>: 3D local densities inside the nanopore</p> <p> </p> <h3>Notes</h3> <p>v3: This version contains <code>gce-position-dR_eq_{δR}.npz</code> which used to have to be regenerated from raw QMC data.</p> <p>v2: This version contains an updated <code>dR_eq_2.0.tar.gz</code> (the one in v1 was corrupted).</p> <p> </p>
ShareScore
44/100
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
- 4