From a3ed1497108256a018804f6ddf2be93cffa725ce Mon Sep 17 00:00:00 2001 From: Ruocheng Han <ruocheng.han@chem.uzh.ch> Date: Fri, 21 May 2021 09:01:18 +0000 Subject: [PATCH] Update README.md --- README.md | 11 ++++++++--- 1 file changed, 8 insertions(+), 3 deletions(-) diff --git a/README.md b/README.md index 3f79853..954b4c6 100644 --- a/README.md +++ b/README.md @@ -2,9 +2,14 @@ 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) -Requirement of python packages: +Requirement of python packages: \ +```python numpy, scipy, h5py, torch, quadpy, itertools, mmap, tqdm -Optional of python packages: -pycuda, skcuda (if you use GPU for preparing Ajb) +``` +Optional of python packages: \ +```python +pycuda, skcuda #if you use GPU for preparing Ajb +``` + -- GitLab