Welcome
We are a young group at the Department of Chemistry at KTH led by Nanna H. List. We develop and apply theoretical methods to explore ultrafast photoinduced correlated electronic and nuclear motion and address questions relevant for energy harvesting, transport, conversion and storage. Intermolecular energy and charge flow is a paradigm in biological systems . Diffraction and spectroscopic techniques provide the bridge between our theoretical work and experiments performed by our collaborators.
If you are a Bachelor Student, Master student, PhD or PostDoc who wants to join the group, read more here.
News
Welcome to Twana and Anders who joined the group!
2-year postdoc scholarship in theoretical chemistry
Paper out! Chemical control of excited-state reactivity in GFP
Welcome to Martin van Horn who joins as a PostDoc
Recent publications
Chemical control of excited-state reactivity of the anionic green fluorescent protein chromophore
Nanna H. List, Chey M. Jones, Todd J. Martínez
Commun Chem 7, 25 (2024)
Femtosecond electronic and hydrogen structural dynamics in ammonia imaged with ultrafast electron diffraction
Elio G. Champenois, Nanna H. List, Matthew Ware, Mathew Britton, Philip H. Bucksbaum, Xinxin Cheng, Martin Centurion, James P. Cryan, Ruaridh Forbes, Ian Gabalski, Kareem Hegazy, Matthias C. Hoffmann, Andrew J. Howard, Fuhao Ji, Ming-Fu Lin, J. Pedro F. Nunes, Xiaozhe Shen, Jie Yang, Xijie Wang, Todd J. Martinez, Thomas J. A. Wolf
Phys. Rev. Lett. 131, 143001 (2023)
Deciphering Methylation Effects on S2(ππ*) Internal Conversion in the Simplest Linear α,β-Unsaturated Carbonyl
Pratip Chakraborty, Rafael C. Couto, and Nanna H. List
J. Phys. Chem. A 2023, 127, 25, 5360–5373
Transition moments beyond the electric-dipole approximation: Visualization and basis set requirements
Martin van Horn, Nanna Holmgaard List, Trond Saue
J. Chem. Phys. 158, 184103 (2023)
Steric and Electronic origins of fluorescence in GFP and GFP-like proteins
Chey M. Jones, Nanna H. List, Todd J. Martinez.
J. Am. Chem. Soc. 2022, 144, 28, 12732
Probing Chirality across the Electromagnetic Spectrum with the Full Semi-classical Light–Matter Interaction
Martin van Horn, Trond Saue, and Nanna Holmgaard List,
J. Chem. Phys. 156, 054113 (2022)