The formation of highly excited H in the reaction H 2 + ( v ) + H 2 → H + H
A quasiclassical trajectory surface hopping method has been used to study H ( v ) + H 2 → H + H for v = 0, 3, 7, 10, 13, and 17 with an emphasis on determining the H internal energy and angular momentum distributions for high v . For v = 13 and 17, significant cross sections are found for producing...
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Veröffentlicht in: | International journal of quantum chemistry 1987-01, Vol.31 (1), p.57-63 |
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Hauptverfasser: | , , |
Format: | Artikel |
Sprache: | eng |
Online-Zugang: | Volltext |
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Zusammenfassung: | A quasiclassical trajectory surface hopping method has been used to study H
(
v
) + H
2
→ H
+ H for
v
= 0, 3, 7, 10, 13, and 17 with an emphasis on determining the H
internal energy and angular momentum distributions for high
v
. For
v
= 13 and 17, significant cross sections are found for producing H
at energies above its dissociation energy. An average metastable H
lifetime of 11.5 ps for
v
= 13 and 4.7 ps for
v
= 17 is found, but there is also a much longer lived component to the lifetime distributions that is more important for
v
= 13 than for
v
= 17. Some of the longer lived metastables correspond to high angular momentum orbiting states of
H
, but other sources of metastability are also present. |
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ISSN: | 0020-7608 1097-461X |
DOI: | 10.1002/qua.560310107 |