“Know how to solve every problem that has been solved.”“What I cannot create, I do not understand.”— Richard Feynman
Project 1 — The Boys function
Quantum Chemistry
Over six projects you will write a complete Hartree-Fock program for H₂ in STO-3G, in the
editor below, checked at every step against reference values from a converged calculation.
First brick: the one special function the whole pipeline needs.