Calculation of density of states of transition metals: from bulk sample to nanocluster

Abstract

The technique is presented of restoring the electronic density of states of the valence band from data of X-ray photoelectron spectroscopy. The originality of the technique consists in using a stochastic procedure to solve an integral equation relating the density of states and the experimental X-ray photoelectron spectra. The results are presented for bulk sample of gold and nanoclusters of tantalum; the possibility of using the results to determine the density of states of low-dimensional structures, including ensembles of metal nanoclusters, is demonstrated.