The inelastic scattering of N2 molecules from silica surfaces, taken at 100 K, has been investigated by adopting a semiclassical collision model in conjunction with the appropriate treatment of the long-range interaction forces. Such forces promote the formation of the precursor state that controls all basic elementary processes occurring at the gas-surface interphase. The probabilities for the different elementary surface processes triggered by quartz are determined and compared with those recently obtained for another silica polymorph (cristobalite). In addition, the final rotovibrational distributions of N2 molecules undergoing inelastic scattering have been characterized. N2 molecules, impinging on both considered surfaces in low-medium vibrational states, preserve the initial vibrational state, while those inelastically scattered are rotationally excited and translationally colder. The surface temperature effect, investigated by raising the temperature itself from 100 K up to 1000 K, emerges more sharply for the cristobalite polymorph, mainly for the molecules impinging in the ground roto-vibrational state and with low collision energies.
Scattering of N2 Molecules from Silica Surfaces: Effect of Polymorph and Surface Temperature
Rutigliano Maria; Pirani Fernando
Journal:
Molecules (Basel, Online) 27 pp. 7445-1 - 7445-19
Year:
2022
ISTP Authors: Maria Rutigliano
Keywords: Reaction Mechanism, Roto-Vibrational distributions, Molecular Dynamics simulations, Long-range interactions, Potential Energy Surface, Surface Processes
Research Activitie: JOURNAL ARTICLES
Related products
-
Chemical physics letters (Print) 773 pp. 138603-1 - 138603-6 Year: 2021 DOI: 10.1016/j.cplett.2021.138603
Dispersion energy effects on oxygen interaction with cesiated molybdenum surfaces
Sanna N.; Rutigliano M.; Palma A.
-
Physical review. E (Print) 104 (2), pp. 025201-1 - 025201-13 Year: 2021 DOI: 10.1103/PhysRevE.104.025201
Transition to turbulence in a five-mode Galerkin truncation of two-dimensional magnetohydrodynamics
Carbone, Francesco; Telloni, Daniele; Zank, Gary; Sorriso-Valvo, Luca
-
Nuclear fusion (Online) 61 (4), pp. 046020-1 - 046020-12 Year: 2021 DOI: 10.1088/1741-4326/abe3c7
Onset of tearing modes in plasma termination on JET: The role of temperature hollowing and edge cooling
Pucella G.; Buratti P.; Giovannozzi E.; Alessi E.; Auriemma F.; Brunetti D.; Ferreira D.R.; Baruzzo M.; Frigione D.; Garzotti L.; Joffrin E.; Lerche E.; Lomas P.J.; Nowak S.; Piron L.; Rimini F.; Sozzi C.; Van Eester D.
English
Italiano