diff --git a/README.md b/README.md index 7a076317d0e545518f5525bc61c50e31b1c2626b..2f4ec3e545a8f029d57e1f87d104a661669ef64d 100644 --- a/README.md +++ b/README.md @@ -28,7 +28,7 @@ train set file, POSCAR file, n value as well as parameters for the SOAP and Gaus The code to create AEM image like "Ag111_AEM.pdf" is also given and uses matplotlib package. Run in same repository as "results.txt" obtained previously to create AEM pdf map. -## Data bases +## Data sets Two data bases are given in this git. The minimum working exemple is focused on the adsorption of Hydrogen on Ag(111). We also give the data for Hydrogen adsorption on Al<sub>13</sub>Co<sub>4</sub>(100) on wich the related [paper](https://doi.org/10.1021/acs.jctc.4c00367) focuses.