Publications of Sebastian Matera

Journal Article (7)

2023
Journal Article
S. Dortaj and S. Matera: Efficient global sensitivity analysis of kinetic Monte Carlo simulations using Cramérs-von Mises distance. The Journal of Chemical Physics 159 (9), 094110 (2023).
Journal Article
K.C. Lai, S. Matera, C. Scheurer and K. Reuter: A fuzzy classification framework to identify equivalent atoms in complex materials and molecules. The Journal of Chemical Physics 159 (2), 024129 (2023).
2022
Journal Article
G. Brösigke, J.-U. Repke, R. Schomäcker and S. Matera: The closer the better? Theoretical assessment of the impact of catalytic site separation for bifunctional core-shell catalyst particles. Chemical Engineering Journal 446 (1), 136891 (2022).
2011
Journal Article
S. Matera, H. Meskine and K. Reuter: Adlayer inhomogeneity without lateral interactions: Rationalizing correlation effects in CO oxidation at RuO2(110) with first-principles kinetic Monte Carlo. The Journal of Chemical Physics 134, 064713 (2011).
2010
Journal Article
S. Matera and K. Reuter: Transport limitations and bistability for in situ CO oxidation at RuO2(110): First-principles based multiscale modeling. Physical Review B 82 (08), 085446 (2010).
2009
Journal Article
S. Matera and K. Reuter: First-principles approach to heat and mass transfer effects in model catalyst studies. Catalysis Letters 133 (1-2), 156–159 (2009).
Journal Article
H. Meskine, S. Matera, M. Scheffler, K. Reuter and H. Metiu: Examination of the concept of degree of rate control by first-principles kinetic Monte Carlo simulations. Surface Science 603 (10-12), 1724–1730 (2009).

Conference Paper (1)

2023
Conference Paper
S. Matera, C. Merdon and D. Runge: Reduced Basis Approach for Convection-Diffusion Equations with Non-linear Boundary Reaction Conditions. In: Finite Volumes for Complex Applications X-Volume 1, Elliptic and Parabolic Problems. (Eds.): E. Franck, J. Fuhrmann, V. Michel-Dansac, and L. Navoret. (Springer Proceedings in Mathematics & Statistics, Vol. 432). Springer, Cham, 335–343 (2023).

Talk (5)

Thesis - PhD (2)

2022
Thesis - PhD
S. Döpking: Error aware analysis of multi-scale reactivity models for chemical surface reactions. Freie Universität Berlin
2010
Thesis - PhD
S. Matera: A First-Principles Based Multiscale Approach from the Electronic to the Continuum Regime: CO Oxidation at RuO2(110). Technische Universität Berlin Berlin
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