From b9f4ac4d76e01ad732a8801f59cf0fcfdf8bcaa1 Mon Sep 17 00:00:00 2001 From: BOULANGEOT Nathan <nathan.boulangeot@univ-lorraine.fr> Date: Mon, 29 Jul 2024 09:46:13 +0000 Subject: [PATCH] Update README.md --- README.md | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/README.md b/README.md index 7a07631..2f4ec3e 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. -- GitLab