Published August 17, 2014 | Version v1
Journal article

Graphene and graphite, low-temperature catalysts producing weakly-excited hydrogen molecules

  • 1. Physik Department, Technische Universität München, D-85747 Garching bei München (Germany)
  • 2. Institute of Theoretical Chemistry, Ulm University, D-89069 Ulm (Germany)

Description

Highlights: • We propose a new model for the low-temperature catalysis of hydrogen molecules on graphite. • Coupled channel calculations including interaction with phonons were performed. • Desorbing molecules have only low internal excitation energy, in agreement with experiments. - Abstract: A model for the low-temperature catalysis of hydrogen molecules on graphene and graphite, relevant for interstellar chemistry, is proposed: hydrogen atoms are either chemisorbed at the edges, or physisorbed on graphene and transported to a chemisorbed state at the edges. A second atom can then produce a molecule via a hot atom or an Eley–Rideal process. Since much of the energy is needed to desorb the molecule from the tightly-bound chemisorbed state, the desorbing molecules have only low internal excitation energy, in agreement with astronomical observations

Availability note (English)

Available from http://dx.doi.org/10.1016/j.chemphys.2014.05.018

Additional details

Identifiers

DOI
10.1016/j.chemphys.2014.05.018;
PII
S0301-0104(14)00158-X;

Publishing Information

Journal Title
Chemical Physics
Journal Volume
439
Journal Page Range
p. 117-120
ISSN
0301-0104
CODEN
CMPHC2

Optional Information

Copyright
Copyright (c) 2014 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.