The static-static distorted-wave method has been applied to the H+ D,(u = 0. , = 0) + HD(v'. J')+D reaction on the LSTH potential energy surface at four energies. A new static distortion potential has been used that is obtained from the preferred collinear configuration of the atoms together with an
The reaction H + D2 → HD + D: Distorted wave calculations at Etrans (υ = 0,j 0) = 0.55 and 1.3 eV
✍ Scribed by J.N.L. Connor; W.J.E. Southall
- Publisher
- Elsevier Science
- Year
- 1984
- Tongue
- English
- Weight
- 393 KB
- Volume
- 108
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
Static-static
distorted wave and vibrationally adiabatic distorted wave calculations have been performed for the product rotational distributions of the H.+ Dz + HD + D reaction using an accurate ab initio potential energy surface. Comparison is made with coupled states and quasiclassical trajectory calculations as well as with esperimental measurements.
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