psi4

1.1-8.add49b9git.fc29.x86_64 : An ab initio quantum chemistry package

Debian Debian
RUN apt-get update && \ apt-get install -y psi4
Ubuntu
RUN apt-get update && \ apt-get install -y psi4
Fedora
RUN dnf install -y psi4-1
Raspbian
RUN apt-get update && \ apt-get install -y psi4
click the source code to copy install psi4 on any operating system with command-not-found.com