Diana van Duin

Atmospheric oxidation chemistry and ozone production: Results from SHARP 2009 in Houston, Texas

Xinrong Ren, Diana van Duin, M. Cazorla et al. · Journal of Geophysical Research Atmospheres · 2013 · 172 citations · Full text

Radical Emission, Engineering, Atmospheric Photochemistry +18

Development of the ReaxFF Methodology for Electrolyte–Water Systems

Mark Fedkin, Yun Kyung Shin, Nabankur Dasgupta et al. · The Journal of Physical Chemistry A · 2019 · 88 citations

Development of a ReaxFF potential for Ag/Zn/O and application to Ag deposition on ZnO

Adam L. Lloyd, David Cornil, Adri C. T. van Duin et al. · Surface Science · 2015 · 55 citations · Full text

Materials Science, Engineering, Corrosion +7

A ReaXFF carbon potential for radiation damage studies

Roger Smith, Kenny Jolley, C. D. Latham et al. · Nuclear Instruments and Methods in Physics Research Section B Beam Interactions with Materials and Atoms · 2016 · 33 citations · Full text

Development and Validation of a ReaxFF Reactive Force Field for Modeling Silicon–Carbon Composite Anode Materials in Lithium-Ion Batteries

Stéphane B. Olou’ou Guifo, Jonathan E. Mueller, Diana van Duin et al. · The Journal of Physical Chemistry C · 2023 · 26 citations

Engineering, Molecular Dynamics, Force Field +19