From f61ea036a5cc21b579bf0656999b6610aadaebd5 Mon Sep 17 00:00:00 2001
From: kkly1995 <37456935+kkly1995@users.noreply.github.com>
Date: Tue, 9 Aug 2022 13:17:43 -0500
Subject: [PATCH] Update README.md

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 README.md | 3 ++-
 1 file changed, 2 insertions(+), 1 deletion(-)

diff --git a/README.md b/README.md
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-# LaH10
+# Data for modeling fcc-LaH<sub>10</sub>
  
+Here we provide the training / testing data, and subsequent DP models used in our paper. The data are given in two formats: exactly as was used in training (slightly outdated DP format) as well as the extended xyz format readable by ASE. Both the raw and subtracted energies, forces, and stresses are included. `deepmd-kit 1.3.4` was used for both training and simulation.