An Ab Initio Description of the Mott Metal-Insulator Transition of M${}_2$ Vanadium Dioxide

Jamie M. Booth, Daniel W. Drumm, Phil S. Casey +3

Using an \textit{ab initio} approach based on the GW approximation which includes strong local \textbf{k}-space correlations, the Metal-Insulator Transition of M${}_2$ vanadium dioxi…