radial wavefunctions

DFT for an atom

Introduction I have a new project on GitHub1. The project is using Density Functional Theory to do calculations for an atom. The project is actually not so new, I’ve put it on GitHub more than three months ago, but it had some issues I had to solve and also I did not have patience until … Read moreDFT for an atom

d orbital

DFT for a Quantum Dot

Introduction This post is describing another project that is leading (hopefully) towards something a little more serious: DFT Quantum Dot1. It will be a very short description because it’s Sunday. As usual, here is the program in action: It displays the quantum dot ‘orbitals’ with VTK volume rendering. Do not assign much physical reality to … Read moreDFT for a Quantum Dot