ExportPairPotentials (Module)
Export pair potential data
Overview
The ExportPairPotentials module writes interatomic pair potential data to disk, one file per unique pair potential.
Options
Targets
| Keyword | Arguments | Default | Description |
|---|---|---|---|
Configuration |
Configuration |
– | Required Target configuration on which to operate. |
File
| Keyword | Arguments | Default | Description |
|---|---|---|---|
Format |
PairPotentialFileAndFormat |
– | Format and base filename of the pair potential files to write to disk. |
Last modified April 23, 2024: Update release notes. (70ff745)