Niels Hansen

Quantum Chemical Modeling of Benzene Ethylation over H-ZSM-5 Approaching Chemical Accuracy: A Hybrid MP2:DFT Study

Niels Hansen, Torsten Kerber, Joachim Sauer et al. · Journal of the American Chemical Society · 2010 · 167 citations

Engineering, Chemical Analysis, Benzene Ethylation +18

Theoretical Investigation of Benzene Alkylation with Ethene over H-ZSM-5

Niels Hansen, Till C. Brüggemann, Alexis T. Bell et al. · The Journal of Physical Chemistry C · 2008 · 90 citations

Materials Science, Organic Charge-transfer Compound, Engineering +12

Analysis of Diffusion Limitation in the Alkylation of Benzene over H-ZSM-5 by Combining Quantum Chemical Calculations, Molecular Simulations, and a Continuum Approach

Niels Hansen, Rajamani Krishna, Jasper M. van Baten et al. · The Journal of Physical Chemistry C · 2008 · 88 citations

Engineering, Intrinsic Kinetics, Computational Chemistry +21

Theoretical Simulation of n-Alkane Cracking on Zeolites

Joseph A. Swisher, Niels Hansen, Theo L. M. Maesen et al. · The Journal of Physical Chemistry C · 2010 · 84 citations · Full text

Engineering, Computational Chemistry, Chemistry +19

A Reaction Mechanism for the Nitrous Oxide Decomposition on Binuclear Oxygen Bridged Iron Sites in Fe-ZSM-5

Niels Hansen, Andreas Heyden, Alexis T. Bell et al. · The Journal of Physical Chemistry C · 2007 · 82 citations

Engineering, Oxidation Resistance, Chemistry +18