Articles

Advanced climate model evaluation with ESMValTool v2.11.0 using parallel, out-of-core, and distributed computing

Publication in Geoscientific Model Development [ doi | pdf ]

2025-07-02

Convective shutdown in the atmospheres of lava worlds

Publication in Monthly Notices of the Royal Astronomical Society [ doi | pdf ]

2024-12-24

Duqtools: Dynamic uncertainty quantification for Tokamak reactor simulations modelling

Publication on arXiv [ doi | pdf ]

2024-09-20

Optimizing ionic transport in argyrodites: a unified view on the role of sulfur/halide distribution and local environments

Publication in J. Mater. Chem. A [ doi | pdf ]

2024-09-09

Non-utopian optical properties computed of a tomographically reconstructed real photonic band gap crystal

Publication in Optics Express [ doi | pdf ]

2024-02-14

Nanomesh: A Python workflow tool for generating meshes from image data

Publication in JOSS [ doi | pdf ]

2022-10-09

The eWaterCycle platform for Open and FAIR Hydrological collaboration

Publication in Geosci. Model Dev. [ doi | pdf ]

2022-07-14

Exploring Polycrystalline Materials: High-throughput Phase Elucidation Using Serial Rotation Electron Diffraction

Publication in ChemRxiv [ doi | pdf ]

2021-10-27

InsteaDMatic: towards cross-platform automated continuous rotation electron diffraction

Publication in J. Appl. Crystallogr. [ doi | pdf ]

2020-10-01

SSZ-27: A Small-Pore Zeolite with Large Heart-Shaped Cavities Determined by Using Multi-crystal Electron Diffraction

Publication in Angew. Chem. Int. Ed. [ doi | pdf ]

2019-09-09

The Role of Cluster Analysis in Automated Serial Electron Crystallography

Publication in Microsc. Microanal. [ doi | pdf ]

2019-08-05

Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination

Publication in IUCrJ [ doi | pdf ]

2019-07-12

Preferential Siting of Aluminum Heteroatoms in the Zeolite Catalyst Al-SSZ-70

Publication in Angew. Chem. Int. Ed. [ doi | pdf ]

2019-05-06

Synthesis and Structure Determination of SCM-15: A 3D Large Pore Zeolite with Interconnected Straight 12x12x10-Ring Channels

Publication in Chem. Eur. J. [ doi | pdf ]

2019-02-11

Quantitative Phase Analysis for Carbide Characterization in Steel Using Automated Electron Diffraction

Publication in Steel Res. Int. [ doi | pdf ]

2019-01-03

High-throughput continuous rotation electron diffraction data acquisition via software automation

Publication in J. Appl. Crystallogr. [ doi | pdf ]

2018-12-01

Site-Specific Adsorption of CO2 in Zeolite NaK-A

Publication in J. Phys. Chem. C [ doi | pdf ]

2018-11-05

Serial electron crystallography for structure determination and phase analysis of nanocrystalline materials

Publication in J. Appl. Crystallogr. [ doi | pdf ]

2018-10-01

CO2-Induced Displacement of Na+ and K+ in Zeolite |NaK|-A

Publication in J. Phys. Chem. C [ doi | pdf ]

2018-07-10

Multidimensional Disorder in Zeolite IM-18 Revealed by Combining Transmission Electron Microscopy and X-ray Powder Diffraction Analyses

Publication in Cryst. Growth Des. [ doi | pdf ]

2018-02-27

Synthesis and Structure Determination of Large-Pore Zeolite SCM-14

Publication in Chem. Eur. J. [ doi | pdf ]

2017-11-27

Well-Defined Silanols in the Structure of the Calcined High-Silica Zeolite SSZ-70: New Understanding of a Successful Catalytic Material

Publication in J. Am. Chem. Soc. [ doi | pdf ]

2017-11-22

Location of Organic Structure-Directing Agents in Zeolites Using Diffraction Techniques

Book chapter in Structure and Bonding: New Insights into the Chemistry of Organic Templating in the Synthesis of Zeolitic Materials [ doi | pdf ]

2017-08-17

Zeolite Structures

Book chapter in Zeolites in Catalysis: Properties and Applications [ doi | pdf ]

2017-06-07

Serial electron crystallography: merging diffraction data through rank aggregation

Publication in J. Appl. Crystallogr. [ doi | pdf ]

2017-06-01

Synthesis and Characterization of CIT-13, a Germanosilicate Molecular Sieve with Extra-Large Pore Openings

Publication in Chem. Mater. [ doi | pdf ]

2016-09-13

Locating Organic Guests in Inorganic Host Materials from X-ray Powder Diffraction Data

Publication in J. Am. Chem. Soc. [ doi | pdf ]

2016-06-08

Ionothermal Synthesis and Structure of a New Layered Zirconium Phosphate

Publication in Inorg. Chem. [ doi | pdf ]

2015-08-17

Structure analysis of a BEC-type germanosilicate zeolite including the location of the flexible organic cations in the channels

Publication in CrystEngComm [ doi | pdf ]

2015-06-22

Serial snapshot crystallography for materials science with SwissFEL

Publication in IUCrJ [ doi | pdf ]

2015-05-01

SSZ-87: A Borosilicate Zeolite with Unusually Flexible 10-Ring Pore Openings

Publication in J. Am. Chem. Soc. [ doi | pdf ]

2015-02-11

High-Silica Zeolite SSZ-61 with Dumbbell-Shaped Extra-Large-Pore Channels

Publication in Angew. Chem. [ doi | pdf ]

2014-09-22

SSZ-45: A High-Silica Zeolite with Small Pore Openings, Large Cavities, and Unusual Adsorption Properties

Publication in Chem. Mater. [ doi | pdf ]

2014-07-08

Solvent-Mediated Reconstruction of the Metal-Organic Framework HKUST-1 (Cu3(BTC)2)

Publication in Adv. Funct. Mater. [ doi | pdf ]

2014-07-01

Synthesis, Structural Elucidation, and Catalytic Properties in Olefin Epoxidation of the Polymeric Hybrid Material [Mo3O9(2-[3(5)-Pyrazolyl]pyridine)]-<i>n</i>

Publication in Inorg. Chem. [ doi | pdf ]

2014-03-03

A two-dimensional zeolitic imidazolate framework with a cushion-shaped cavity for CO2 adsorption

Publication in Chem. Commun. [ doi | pdf ]

2013-09-19

Using FOCUS to solve zeolite structures from three-dimensional electron diffraction data

Publication in J. Appl. Crystallogr. [ doi | pdf ]

2013-08-01

Hexakis(urea-kO)zinc(II) dinitrate at 110 and 250 K: uniaxial negative thermal expansion

Publication in Acta Cryst. C [ doi | pdf ]

2011-02-15

Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate

Publication in Acta Cryst. B [ doi | pdf ]

2011-02-01

catena-Poly[[bis-(ethylenediamine)copper(II)]-u-sulfato]

Publication in Acta Cryst. E [ doi | pdf ]

2010-06-01