PD Dr. Marek Sierka
Research interests
Density funtional theory methods for extended (periodic) systems, global and local optimization algorithms for gas-phase clusters and surfaces, heterogeneous and homogeneous catalysis
Research Fields in UniCat
2007-2011: A1
Selection of research
UniCat publications
| 622 Structures of the Ordered Water Monolayer on MgO(001) R. Włodarczyk, M. Sierka, K. Kwapień, J. Sauer, E. Carrasco, A. Aumer, J. F. Gomes, M. Sterrer, H. J. Freund Journal of Physical Chemistry C 2011, 115, 6764 - 6774, 10.1021/jp200112c |
| 466 Thickness-Dependent Hydroxylation of MgO(001) Thin Films E. Carrasco, M. A. Brown, M. Sterrer, H.-J. Freund, K. Kwapien, M. Sierka, J. Sauer Journal of Physical Chemistry C 2010, 114, 18207 - 18214, 10.1021/jp105294e |
| 465 Reactions of H2, CH4, C2H6, and C3H8 with [(MgO)(n)](+) Clusters Studied by Density Functional Theory K. Kwapien, M. Sierka, J. Döbler, J. Sauer ChemCatChem 2010, 2, 819 - 826, 10.1002/cctc.201000118 |
| 236 Point defects in CaF2 and CeO2 investigated by the periodic electrostatic embedded cluster method J. Döbler, M. Sierka, A. Burow, J. Sauer The Journal of Chemical Physics 2009, 130, 174710 - 0, 10.1063/1.3123527 |
| 235 The [(Al2O3)2]- Anion Cluster: Electron Localization-Delocalization Isomerism J. Sauer, H. J. Zhai, L. S. Lai-Sheng, J. Döbler, M. Sierka ChemPhysChem 2009, 10, 2410 - 2413, 10.1002/cphc.200900460 |
| 234 Resolution of identity approximation for the Coulomb term in molecular and periodic systems A. Burow, F. Mohamed, M. Sierka The Journal of Chemical Physics 2009, 131, 214101 - 214101, 10.1063/1.3267858 |
