History and Utility of Zeolite Framework-Type Discovery from a Data-Science Perspective
Nils E. R. Zimmermann and Maciej Haranczyk
Cryst. Growth Des., DOI 10.1021/acs.cgd.6b00272, 2016.


Nucleation of NaCl from Aqueous Solution: Critical Sizes, Ion-Attachment Kinetics, and Rates
Nils E. R. Zimmermann, Bart Vorselaars, David Quigley, and Baron Peters
J. Am. Chem. Soc. 137, 13352-13361, 2015.


Transport in Nanoporous Materials Including MOFs: The Applicability of Fick’s Laws
Tobias Titze, Alexander Lauerer, Lars Heinke, Christian Chmelik, Nils E. R. Zimmermann, Frerich J. Keil, Douglas M. Ruthven, and Jörg Kärger
Angew. Chem. Int. Ed. 54, 14580-14583, 2015.
German version: Transport in nanoporösen Materialien, einschließlich MOFs: über die Anwendbarkeit der Fickschen Gesetze, Angew. Chem. 127, 14788-14792, 2015

Transport into Nanosheets: Diffusion Equations Put to Test
Nils E. R. Zimmermann, Timm J. Zabel, and Frerich J. Keil
J. Phys. Chem. C 117, 7384-7390, 2013.

Predicting Local Transport Coefficients at Solid-Gas Interfaces
Nils E. R. Zimmermann, Berend Smit, and Frerich J. Keil
J. Phys. Chem. C 116, 18878-18883, 2012.

Surface Barriers of Hydrocarbon Transport Triggered by Ideal Zeolite Structures
Nils E. R. Zimmermann, Sayee P. Balaji, and Frerich J. Keil
J. Phys. Chem. C 116, 3677-3683, 2012.

Adsorption and diffusion in zeolites: The pitfall of isotypic crystal structures
Nils E. R. Zimmermann, Maciej Haranczyk, Manju Sharma, Bei Liu, Berend Smit, and Frerich J. Keil
Mol. Simul. 37, 986-989, 2011.

Addition/Correction: In-Depth Study of the Influence of Host-Framework Flexibility on the Diffusion of Small Gas Molecules in One-Dimensional Zeolitic Pore Systems
Nils E. R. Zimmermann, Sven Jakobtorweihen, Edith Beerdsen, Berend Smit, and Frerich J. Keil
J. Phys. Chem. C 114, 15546-15546, 2010.

On the Effects of the External Surface on the Equilibrium Transport in Zeolite Crystals
Nils E. R. Zimmermann, Berend Smit, and Frerich J. Keil
J. Phys. Chem. C 114, 300-310, 2010.

Path Sampling Calculation of Methane Diffusivity in Natural Gas Hydrates from a Water-Vacancy Assisted Mechanism
Baron Peters, Nils E. R. Zimmermann, Gregg T. Beckham, Jefferson W. Tester, and Bernhardt L. Trout
J. Am. Chem. Soc. 130, 17342-17350, 2008.

In-Depth Study of the Influence of Host-Framework Flexibility on the Diffusion of Small Gas Molecules in One-Dimensional Zeolitic Pore Systems
Nils E. R. Zimmermann, Sven Jakobtorweihen, Edith Beerdsen, Berend Smit, and Frerich J. Keil
J. Phys. Chem. C 111, 17370-17381, 2007.