
Windows \ conda install -c raimis -c psi4 -c conda-forge psi4=1.3.2 \Ĭonda install psi4 psi4-rt python=3.7 -c psi4 Use the correct command for your operating system. If additional packages are required, this information is provided in the instructor notes for that lab. Most Psi4Education Jupyter notebook labs use Psi4, matplotlib, and numpy instructions for installing these packages are given below.


We recommend setting up a conda environment for using psi4. Create a conda environment for Psi4Įnvironments let you install a particular set of packages, without messing up anything else you already have installed on your computer. If you would prefer to save space on your computer, you can install miniconda, which will not install a lot of these extra packages. It automatically installs lots of useful python packages. Note: Anaconda is a rather large download. If you are on Windows, make sure to choose the option Make Anaconda the default Python during installation. Double click the installer and follow the setup instructions, keeping most of the default options.

Be sure you get the installer listed under Python 3 (not 2).
