Calculating Hirshfeld-I charges in solids: Implementation, pitfalls and applications

D.E.P. Vanpoucke, S. Van Damme, S. Cottenier, P. Bultinck, I. Van Driessche, V. Van Speybroeck

CMN4

ISBN/ISSN:

Talk

Conference / event / venue

Belgian Physical Society Meeting

Louvain-la-neuve, Belgium

Wednesday, 22 May, 2013