102 citations · 471 across the 14 of their papers we have counts for
6 papers · 1 filter
Time-resolved solvation dynamics of Li, Na and K ions in liquid helium nanodroplets
Jeppe K. Christensen, Simon H. Albrechtsen, Christian E. Petersen +7
In 2023, ultrafast pump-probe spectrocopy was used to record the solvation dynamics of a single Na ion in a liquid helium droplet, atom-by-atom and with femtosecond time resolu…
Reconciling Experimental and Theoretical Vibrational Deactivation in Low-Energy O+N Collisions
Qizhen Hong, Massimiliano Bartolomei, Fabrizio Esposito +3
Molecular dynamics calculations of inelastic collisions of atomic oxygen with molecular nitrogen are known to show orders of magnitude discrepancies with experimental results in th…
First Principles Investigation of Hydrogen Physical Adsorption on Graphynes' layers
Massimiliano Bartolomei, Estela Carmona-Novillo, Giacomo Giorgi
Graphynes are 2D porous structures deriving from graphene featuring triangular and regularly distributed subnanometer pores, which may be exploited to host small gaseous species. F…
Global potential energy surface for the O2 + N2 interaction. Applications to the collisional, spectroscopic, and thermodynamic properties of the complex
Massimiliano Bartolomei, Estela Carmona-Novillo, Marta I. Hernádez +2
A detailed characterization of the interaction between the most abundant molecules in air is important for the understanding of a variety of phenomena in atmospherical science. A c…
The penetration barrier of water through graphynes' pores: first-principles predictions and force field optimization
Massimiliano Bartolomei, Estela Carmona-Novillo, Marta I. Hernández +4
Graphynes are novel two-dimensional carbon-based materials that -due to their nanoweb-like structure- have been proposed as molecular filters, especially for water purification tec…
Effect of the anisotropy on the glory structure of molecule-molecule scattering cross sections
Jesús Pérez-Ríos, Massimiliano Bartolomei, José Campos-Martínez +1
Total (elastic + rotationally inelastic) integral cross sections are computed for O-O using a recent ab initio potential energy surface. The sampled veloc…