diff --git a/INSTALL.md b/INSTALL.md new file mode 100644 index 0000000..9ebb816 --- /dev/null +++ b/INSTALL.md @@ -0,0 +1,15 @@ +The QuAcK software can be downloaded on GitHub as a Git repository +``` +git clone https://github.com/pfloos/QuAcK.git +``` + +Then, one must define the variable `QUACK_ROOT`. For example, +``` +export QUACK_ROOT=$HOME/Work/QuAcK +``` +You must also install [PySCF](https://pyscf.org) (for example using `pip`) +``` +pip install pyscf +``` + +PySCF is used for the computation of one- and two-electron integrals (mainly). diff --git a/INSTALL.txt b/INSTALL.txt deleted file mode 100644 index 8b13789..0000000 --- a/INSTALL.txt +++ /dev/null @@ -1 +0,0 @@ -