Adhikari, Satrajit ; Billing, Gert D. (1998) Semiclassical reactive scattering: the Hermite correction method in hyperspherical coordinates Chemical Physics, 238 (1). pp. 69-84. ISSN 0301-0104
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Official URL: http://doi.org/10.1016/S0301-0104(98)00302-4
Related URL: http://dx.doi.org/10.1016/S0301-0104(98)00302-4
Abstract
We have used the classical path theory based on the Hermite correction to Gaussian wave packets by G.D. Billing to treat three center reactions using hyperspherical coordinates. With this approach the probabilities for the D + H2 (v=0,j=0) → HD (v′,j′) + H, reaction have been calculated for the J=0 case. The results are compared with those of J.Z.H. Zhang and W.H. Miller obtained by time-independent scattering calculations.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to Elsevier Science. |
| ID Code: | 136375 |
| Deposited On: | 20 May 2025 07:41 |
| Last Modified: | 20 May 2025 07:41 |
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