Quantum wave-packet dynamics of H+HLi scattering: Reaction cross section and thermal rate constant
Quantum wave-packet dynamics of H+HLi scattering: Reaction cross section and thermal rate constant
| dc.contributor.author | Padmanaban, R. | |
| dc.contributor.author | Mahapatra, S. | |
| dc.date.accessioned | 2022-03-27T00:15:53Z | |
| dc.date.available | 2022-03-27T00:15:53Z | |
| dc.date.issued | 2004-10-22 | |
| dc.description.abstract | The channel specific and initial state selected reaction cross section, and temperature dependent rate constant of a H+HLi scattering system was calculated. The partial-wave contributions up to the total angular momentum J=74 were calculated within the coupled states (CS) approximation. Companion computations were also performed using the standard as well as the uniform J-shifting (JS) approximation. The overall variation of reaction cross sections was found to correspond well to the behavior of a barrierless reaction. | |
| dc.identifier.citation | Journal of Chemical Physics. v.121(16) | |
| dc.identifier.issn | 00219606 | |
| dc.identifier.uri | 10.1063/1.1794655 | |
| dc.identifier.uri | http://scitation.aip.org/content/aip/journal/jcp/121/16/10.1063/1.1794655 | |
| dc.identifier.uri | https://dspace.uohyd.ac.in/handle/1/3008 | |
| dc.title | Quantum wave-packet dynamics of H+HLi scattering: Reaction cross section and thermal rate constant | |
| dc.type | Journal. Article | |
| dspace.entity.type |
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