QUANTUM AND QUASICLASSICAL STUDY OF THE COLLINEAR REACTION O(3P)+H2-]OH+H USING A LEPS AND FITTED ABINITIO POTENTIAL-ENERGY SURFACE
Accurate quantum calculations of reaction probabilities PTν′←ν have been carried out for the collinear reaction O(3P) + H2 (ν = 0,1) → OH(ν′) + H using a LEPS and fitted ab initio potential energy surface. The energy dependence of the PTν′ ← ν is similar for both surfaces. Collinear quasiclassical t...
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Bibliographic Details
| Main Authors: |
Clary, D,
Connor, J,
Edge, C |
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| Format: | Journal article
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| Language: | English |
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| Published: |
1979
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