Oxygen Adsorption on β-Quartz Model Surfaces: Some Insights from Density Functional Theory Calculations and Semiclassical Time-Dependent Dynamics-Reference-Cited by-同舟云学术

Oxygen Adsorption on β-Quartz Model Surfaces: Some Insights from Density Functional Theory Calculations and Semiclassical Time-Dependent Dynamics

Published:2012-02-22 Issue:9 Volume:116 Page:1975-1983
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Zazza Costantino¹,Rutigliano Maria²,Sanna Nico¹,Barone Vincenzo³,Cacciatore Mario²

Affiliation:

1. CASPUR Consorzio Interuniversitario Applicazioni Supercalcolo per Università e Ricerca, Via dei Tizii 6b, 00185 Roma, Italy

2. CNR-IMIP, Istituto di Metodologie Inorganiche e dei Plasmi, Via Amendola 122/D, 70126 Bari, Italy

3. Scuola Normale Superiore di Pisa, Piazza dei Cavalieri 7, 56126 Pisa, Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp205517j

Reference25 articles.

1. Model for oxygen recombination on reaction-cured glass

2. Dynamics of plasma–surface processes: E–R and L–H atom recombination reactions

3. Material-dependent catalytic recombination modeling for hypersonic flows

4. Cacciatore, M.; Rutigliano, M.Molecular dynamics simulation of surface processes: oxygen recombination on silica surfaces at high temperatures.Experiments, Modelling and Simulation of Gas-surface Interactions for Reactive Flows in Hypersonic Flights; Educational Notes RTO-EN-AVT-142 Editor: Research and Technology Organisation (NATO) BP 25, F-92201 Neuilly-sur-Seine Cedex, France, ISBN978-92-837-0057-9, Paper 5 (2007).

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