📝 Selected publications

See my Google Scholar profile for the full list.

1. Dynamics of Electrified Interfaces and Hydrogen Evolution from Density Functional Theory
   Doctoral thesis, Aalto University publication series, 162/2022.
   Rasmus Kronberg
   pdf
2. Dynamics and Surface Propensity of H⁺ and OH⁻ within Rigid Interfacial Water: Implications for Electrocatalysis
   The Journal of Physical Chemistry Letters 2021, 12, 41, 10128-10134.
   Rasmus Kronberg and Kari Laasonen
   pdf
3. Hydrogen Adsorption on Defective Nitrogen-Doped Carbon Nanotubes Explained via Machine Learning Augmented DFT Calculations and Game-Theoretic Feature Attributions
   The Journal of Physical Chemistry C 2021, 125, 29, 15918-15933.
   Rasmus Kronberg, Heikki Lappalainen and Kari Laasonen
   pdf
4. Reconciling the Experimental and Computational Hydrogen Evolution Activities of Pt(111) through DFT-Based Constrained MD Simulations
   ACS Catalysis 2021, 11, 13, 8062-8078.
   Rasmus Kronberg and Kari Laasonen
   pdf
5. Coupling Surface Coverage and Electrostatic Effects on the Interfacial Adlayer–Water Structure of Hydrogenated Single-Crystal Platinum Electrodes
   The Journal of Physical Chemistry C 2020, 124, 25, 13706-13714.
   Rasmus Kronberg and Kari Laasonen
   cover pdf
6. Revisiting the Volmer–Heyrovský mechanism of hydrogen evolution on a nitrogen doped carbon nanotube: constrained molecular dynamics versus the nudged elastic band method
   Physical Chemistry Chemical Physics 2020, 22, 19, 10536-10549.
   Rasmus Kronberg, Heikki Lappalainen and Kari Laasonen
   pdf

I have in addition acted as a reviewer for the following journals:

• Chemistry Letters
• The Journal of Chemical Physics
• The Journal of Physical Chemistry C