Publications of Ville Havu

Havu, P.; Blum, V.; Havu, V.; Rinke, P.; Scheffler, M.: Large-scale surface reconstruction energetics of Pt(100) and Au(100) by all-electron density functional theory. Physical Review B 82 (161418(R)) (2010)

Havu, V.; Blum, V.; Havu, P.; Scheffler, M.: Efficient O(N) integration for all-electron electronic structure calculation using numeric basis functions. Journal of Computational Physics 228 (22), pp. 8367 - 8370 (2009)

Blum, V.; Gehrke, R.; Hanke, F.; Havu, P.; Havu, V.; Ren, X.; Reuter, K.; Scheffler, M.: Ab initio molecular simulations with numeric atom-centered orbitals. Computer Physics Communications 180, pp. 2175 - 2196 (2009)