Most of the density-to-potential inversion methods developed over the years follow a general algorithm vxci+1(r)=vxci(r)+Δvxc(r), where Δvxc(r)=δρ(r)δS[ρ]ρi(r)−δρ(r)δS[ρ]ρ0(r) and S[ρ] is an appropriately chosen density functional. In this work we show that this algorithm can be used with random numbers to obtain the exchange-correlation potential for a given density. This obviates the need to evaluate the functional S[ρ] in each iterative step. The method is demonstrated by calculating exchange-correlation potential of atoms, clusters and the Hookium.
@article{arxiv.2006.00324,
title = {Using random numbers to obtain Kohn-Sham potential for a given density},
author = {Ashish Kumar and Manoj K. Harbola},
journal= {arXiv preprint arXiv:2006.00324},
year = {2021}
}