Dr. rer. nat. Kai Sellschopp
![Kai Sellschopp Wtn-staff Picture Kai-sellschopp 2023-04-13](/imperia/md/assets/main/institutes/hydrogen_technology/material_design/images/team/fittosize_150_0_1b7c3426892c0ec53190e9e847febd8f_wtn-staff_picture_kai-sellschopp_2023-04-13.jpg)
Dr. rer. nat. Kai Sellschopp
Materials Design
ScientistPhone: +49 (4152) 87-2634
Fax: +49 (4152) 87-2625
Atomistic Modelling and Simulation
- Atomic-scale modelling and simulation of Metal Hydride materials
- Automation of computational workflows
- Nuclear Quantum Effects of Hydrogen in Metals
- Modelling of surfaces and interfaces
2023
- Sellschopp, K., Vonbun-Feldbauer, G.B. (2023) . Mechanical properties of TiO2/carboxylic-acid interfaces from first-principles calculations. Nanoscale, Vol. 15, 42, 16967-16975. DOI: https://doi.org/10.1039/D3NR01045G . OPEN ACCESS
2021
2018