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physics.chem-ph2026
X-ray Driven Trihydrogen Formation on Silica Nanosurfaces
Samuel Sahel-Schackis, Adam Summers, Ritika Dagar +29
The trihydrogen cation () initiates the ion-molecule reactions that build molecular complexity in interstellar space. Whether its canonical formation reaction, $\ma…
physics.chem-ph2019
A DFT-based Tight-Binding Approach to the Self-consistent Description of Molecule Metal-Nanoparticle Interactions
Xiaomeng Liu, Lennart Seiffert, Thomas Fennel +1
The interaction within a hybrid system consisting of a spherical metal nanoparticle and a nearby organic dye molecule is formulated in a combined quantum-classical approach. Wherea…