Multilevel on-the-fly sparse grids for coupling coarse-grained and high fidelity models in heterogeneous catalysis. - Tobias Hülser; Bjarne Kreitz; C. Franklin Goldsmith; Sebastian Matera (Comput. Chem. Eng., 2025)

Influence of Coverage Dependence on the Thermophysical Properties of Adsorbates and Its Impact on Microkinetic Models. - Jongyoon Bae; Bjarne Kreitz; Andrew A. Peterson; C. Franklin Goldsmith (J. Chem. Inf. Model., 2025)