Publications: Scientific computing


These papers are ordered by article relevance.

Propagators for the time-dependent Kohn-Sham equations
A. Castro, M.A.L. Marques, A. Rubio
Journal of Chemical Physics 121, 3425 - 3433 (2004)
A global investigation of excited state surfaces within time-dependent density-functional response theory
M. Wanko, M. Garavelli, F. Bernardi, T. A. Niehaus, Th. Frauenheim,, M. Elstner
Journal of Chemical Physics 120, 1674 - 1692 (2004)