Recent content by kttsbnj

following the web ... worldwideweb.tcm.phy.cam.ac.uk/~ajw29/thesis/node11.html equation 1.34 how can I calculate wavefunction. Basically one must know the energy eigen value first, right?

I try to learn DFT by myself(Kohn-Sham Equations), but the concept is still not so clear for me. So far, if I start with assuming any density, and then I would be able to find V(KS) Then I use this hamiltonian and solve for a wave function. And I use this wave function to find another...