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pro vyhledávání: '"F. Aguillon"'
Akademický článek
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Publikováno v:
Chemical Physics Letters. 498:32-37
We study the Eley–Rideal recombination of H atoms on graphene under the physical conditions of the interstellar medium. Effects of the ZPE motions of the chemisorbed H atom and of the graphene thermal motions are investigated. Classical molecular d
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::226d9c996fbc62666108511d322a4604
https://doi.org/10.1016/j.cplett.2010.08.039
https://doi.org/10.1016/j.cplett.2010.08.039
Akademický článek
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Publikováno v:
ECAMP 8
ECAMP 8, 2004, Rennes, France
ECAMP 8, 2004, Rennes, France
We have studied the formation of the H2 molecule on a graphite surface, when both H atoms are initially physisorbed. The graphite surface is assumed to be planar, and a model potential is obtained in a semiempirical way to reproduce the experimental
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6fab1885b92eb09c8526b8da35d02645
https://doi.org/10.1063/1.1781118
https://doi.org/10.1063/1.1781118
Publikováno v:
The Journal of Physical Chemistry A. 108:8571-8579
A wave packet study of the dynamics of H2 formation through a collinear Eley−Rideal mechanism that explicitly handles the substrate relaxation effects is presented. The substrate used is a planar P...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::aed8a73d705785464804555c331ec03d
https://doi.org/10.1021/jp049969q
https://doi.org/10.1021/jp049969q
Publikováno v:
The Journal of Chemical Physics. 119:12805-12818
The collision-induced multifragmentation of Na4+ alkali metal cluster ions by He impact in the 100 eV (center of mass) collision energy range is investigated theoretically using a DIM-based nonadiabatic molecular dynamics method. Compared to our earl
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4ef4fb4e5814c2d0d174798a5ce65e32
https://doi.org/10.1063/1.1628211
https://doi.org/10.1063/1.1628211
Publikováno v:
Chemical Physics Letters. 378:615-621
A wavepacket study of the dynamics of H 2 formation through a collinear Eley Rideal mechanism that explicitly handles the substrate relaxation effects is presented. The substrate used is a planar polycyclic aromatic hydrocarbon (PAH) which exhibits s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::927a5030bad54d141f61035011bad127
https://doi.org/10.1016/s0009-2614(03)01247-8
https://doi.org/10.1016/s0009-2614(03)01247-8
Autor:
M. Sizun, F. Aguillon
Publikováno v:
Physical Chemistry Chemical Physics. 3:5226-5229
The multifragmentation of metallic clusters (Nan+, 4 ≤ n ≤ 9) induced by He impact in the 100 eV collision energy range is investigated theoretically. The study is based on classical dynamics on a single potential energy surface obtained in the d
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a8d056a4ccc726b0660838b1f3056c64
https://doi.org/10.1039/b105672g
https://doi.org/10.1039/b105672g
Autor:
F. Aguillon, Y. J. Picard, M. Sizun, J.A. Fayeton, Dmitri Babikov, Eric A. Gislason, M Barat, V. Sidis, J.C. Brenot
Publikováno v:
Chemical Physics Letters. 341:568-574
Three-body fragmentation of Na 3 + ions to Na + +Na(1s)+Na(1s) is studied experimentally and theoretically. A procedure is developed for distinguishing the three adiabatic electronic 1A ′ states in the product region, even though these states are d
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2dcfeb4ea30fe6fe5b02ca9dce7d33dd
https://doi.org/10.1016/s0009-2614(01)00554-1
https://doi.org/10.1016/s0009-2614(01)00554-1
Publikováno v:
Monthly Notices of the Royal Astronomical Society. 323:L7-L11
We have performed classical trajectory Monte Carlo calculations of the probabilities of rovibrational excitation and dissociation of molecular hydrogen in collisions with a surface, modelled as MgO. The results show that, in C-type shock waves, state
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::eddde95af079584099fe78cd3ad1421e
https://doi.org/10.1046/j.1365-8711.2001.04473.x
https://doi.org/10.1046/j.1365-8711.2001.04473.x