Vojtech Vlcek

Role of Bismuth Topological and Trivial Surface States in Molecular Adsorption.

Topological materials have recently been proposed as a new class of catalysts, where robust surface states near the Fermi level are expected to influence adsorption and reactivity. In this Letter, using first-principles calculations, we systematically investigate molecular adsorption on bismuth (Bi) slabs across a wide...