DFTB study of silica glass under pressure (figures/samples trajectories) (Q6719014)
From MaRDI portal
 | This is the item page for this Wikibase entity, intended for internal use and editing purposes. Please use this page instead for the normal view: DFTB study of silica glass under pressure (figures/samples trajectories) |
Dataset published at Zenodo repository.
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | DFTB study of silica glass under pressure (figures/samples trajectories) |
Dataset published at Zenodo repository. |
Statements
This deposit contains: 1) Configurations (XYZ format) for selected densities/pressures (~100 configurations) extracted from the corresponding DFTB trajectories. (see configs-2-deposit.zip). The file readme-configs-2-deposit.txt gives details on configuration file and corresponding box size, pressure and density. 2) xmgrace source files of the manuscripts figures (file figures.zip). Each .agr file contains the XY data of the plotted quantities.
0 references
21 June 2021
0 references
