SCF_workshop

Wilson group summer workshop for Hartree-Fock

Edition 2!

Requirements

Day 1. Just need jupyter notebook with the scipy and numpy libraries installed.

Day 2+. Will need Psi4 interface to python, I'll go over how to set it up

Materials

• Day01
  • Includes the Jupyter notebook
• Day02
  • Python code, rhf-tutorial.py, requires installation of Psi4
• Day03
  • Python code, uhf-tutorial.py