In this ongoing project, PySCF (Python-based Simulations Chemistry Framework) will interface with ASE (Atomic Simulation Environment) in order to perform electronic structure calculations. This includes density functional theory approximation technique to find the Hamiltonian of a many-body quantum system.
To view the branch to the ASE source code, visit: https://gitlab.com/landerson24/ase/-/tree/pyscf
To view the source code for PySCF, visit: https://github.com/pyscf/pyscf