diff --git a/README.md b/README.md index 42fcbbad9e7fb7026b42b97bae4fab8a3df0d06d..42fb9c7a052c5a05480983213f3c8e4f9bf49d5a 100644 --- a/README.md +++ b/README.md @@ -1,4 +1,4 @@ -# Møller–Plesset Correlation Energy Density Generator +# Møller–Plesset Correlation Energy Density Calculator This is python code of generating MP2, MP3, and MP4 correlation energy density based on **one boby decomposition scheme** (https://doi.org/10.1002/qua.22017)