Practical Introduction to Hartree-Fock Algorithm using Python
<p>I will assume you have read the first three chapters of “Modern Quantum Chemistry” by Szabo and Ostlund, or any other similar book, or have taken an introductory course into computational quantum chemistry. I will be referring to said book throughout the post. The book is very cheap (£10 on Amazon) and is a good investment.</p>
<p>I’ll also assume you have had a bit of practice coding in python, and know the basics, like how for loops work, etc.</p>
<p>I will go through the important maths again here and there. This is to function as a reminder, and it will not make sense if you are reading about this for the first time. If this is the case, simply refer to the book.</p>
<p><a href="https://medium.com/analytics-vidhya/practical-introduction-to-hartree-fock-448fc64c107b"><strong>Website</strong></a></p>