Machine learning hydrogen adsorption on nanoclusters through structural descriptors MOJ Jäger, EV Morooka, F Federici Canova, L Himanen, AS Foster npj Computational Materials 4 (1), 37, 2018 | 177 | 2018 |
First principles global optimization of metal clusters and nanoalloys M Jäger, R Schaefer, RL Johnston Advances in Physics: X 3 (1), 1516514, 2018 | 44 | 2018 |
GIGA: a versatile genetic algorithm for free and supported clusters and nanoparticles in the presence of ligands M Jäger, R Schäfer, RL Johnston Nanoscale 11 (18), 9042-9052, 2019 | 35 | 2019 |
Efficient machine-learning-aided screening of hydrogen adsorption on bimetallic nanoclusters MOJ Jager, YS Ranawat, FF Canova, EV Morooka, AS Foster ACS combinatorial science 22 (12), 768-781, 2020 | 20 | 2020 |
Doping effects on the geometric and electronic structure of tin clusters M Gleditzsch, M Jäger, LF Pašteka, A Shayeghi, R Schäfer Physical Chemistry Chemical Physics 21 (44), 24478-24488, 2019 | 13 | 2019 |
Optical Properties of Sin+ (n = 6–100) Clusters: The Approach to Bulk Behavior A Lehr, M Jäger, R Schäfer The Journal of Physical Chemistry C 124 (1), 1070-1076, 2019 | 7 | 2019 |
Chemical bonding in initial building blocks of semiconductors: Geometrical structures and optical absorption spectra of isolated CdSe2+ and Cd2Se2+ species M Jäger, A Shayeghi, V Klippenstein, RL Johnston, R Schäfer The Journal of Chemical Physics 149 (24), 2018 | 7 | 2018 |
Size-and Charge-Dependent Optoelectronic Properties of CdSe Clusters: Evolution of the Optical Gap from Molecular to Bulk Behavior M Jäger, J Schneider, R Schäfer The Journal of Physical Chemistry A 124 (1), 185-196, 2019 | 5 | 2019 |
Optical Absorption of Atomically-Precise Sn14 Nanoclusters: The Antagonistic Interplay of Ligand Stabilization, Molecular Symmetry, and Solvatochromism A Lehr, M Jäger, M Gleditzsch, F Rivic, R Schäfer The Journal of Physical Chemistry Letters 11 (18), 7827-7831, 2020 | 4 | 2020 |
From Cd‐Rich to Se‐Rich–The Manipulation of CdSe Nanocluster Structure and Optical Absorption M Jäger, R Schäfer ChemPhysChem 22 (2), 192-196, 2021 | 1 | 2021 |
Variation of the optical properties with size and composition of small, isolated CdxSey+ clusters M Jäger, R Schäfer Journal of Computational Chemistry 42 (5), 303-309, 2021 | | 2021 |
Efficient screening of nanoclusters as catalysts for the hydrogen evolution reaction M Jäger Aalto University, 2020 | | 2020 |
Supplementary Information-GIGA: A Versatile Ge-netic Algorithm for Free and Supported Clusters and Nanoparticles in the Presence of Ligands M Jäger, R Schäfer, RL Johnston | | |