Research Associate

Publications

When Are Dopant d-States Free-Atom-Like? Periodic Trends and Confinement Effects in Single-Atom Alloys.
F Berger, A Michaelides
J Am Chem Soc
(2025)
147
Interaction strength of carbon dioxide on graphene from periodic quantum diffusion Monte Carlo
F Della Pia, G Kler-Young, A Zen, F Berger, D Alfè, A Michaelides
Journal of Chemical Physics
(2025)
163
Modeling Oxidative Dehydrogenation of Propane with Supported Vanadia Catalysts Using Multireference Methods
M Mandal, MR Hermes, F Berger, J Sauer, L Gagliardi
The Journal of Physical Chemistry C
(2025)
129
Modeling Oxidative Dehydrogenation of Propane with Supported Vanadia Catalysts Using Multireference Methods
M Mandal, MR Hermes, F Berger, J Sauer, L Gagliardi
(2025)
Unexpected structural isomers of AlFe2O4+ and AlCo2O4+: vibrational spectroscopy and ion mobility combined with quantum chemistry
W Schwedland, TC Penna, H Windeck, F Müller, S Leach, J Sauer, XR Advincula, F Berger, N Ishida, K Ohshimo, F Misaizu, Y-K Li, A Chakraborty, F Horn, KR Asmis
Chemical Science
(2025)
16
Modeling Oxidative Dehydrogenation of Propane with Supported Vanadia Catalysts Using Multireference Methods
M Mandal, MR Hermes, F Berger, J Sauer, L Gagliardi
(2025)
Cooperative CO2 capture via oxalate formation on metal-decorated graphene
IC Popoola, BX Shi, F Berger, A Michaelides, A Zen, D Alfè, YS Al-Hamdani
Physical Review Materials
(2025)
9
Bringing Molecules Together: Synergistic Coadsorption at Dopant Sites of Single Atom Alloys.
F Berger, J Schumann, R Réocreux, M Stamatakis, A Michaelides
J Am Chem Soc
(2024)
146
Chemically accurate predictions for water adsorption on Brønsted sites of zeolite H-MFI
H Windeck, F Berger, J Sauer
Physical Chemistry Chemical Physics
(2024)
26
Azobenzene isomerization on a reactive copper surface by efficient decoupling with bulky side groups
S Jaekel, R Stoll, F Berger, S Hecht, L Grill
Surface Science
(2024)
744

Postdoctoral researcher

Telephone number

01223 763872 (shared)

Email address