dorsal/arxiv
View SchemaRotational Energy Transfer in H2+H2
| Authors | Renat A. Sultanov, Dennis Guster |
|---|---|
| Categories | |
| ArXiv ID | physics/0605202 |
| URL | https://arxiv.org/abs/physics/0605202 |
| DOI | 10.1016/j.cplett.2006.07.019 |
Abstract
Quantum-mechanical close-coupling calculations for state-to-state cross sections and thermal rates are reported for H2+H2 collisions. Two recently developed potential energy surfaces (PES) for the H2-H2 system are applied, namely, the global potential surface from the work of A.I. Boothroyd, P.G. Martin, W.J. Keogh, M.J. Peterson, J. Chem. Phys., 116 (2002) 666, and a restricted, model surface from the works of P. Diep, J.K. Johnson, J. Chem. Phys., 113 (2000) 3480; ibid. 112, 4465. The low temperature limit is investigated. We found significant differences in cross sections and corresponding thermal rates calculated with these two PESs.
{
"annotation_id": "cdf2d1cf-e404-4315-aaa4-679b2bf80f69",
"date_created": "2026-03-02T18:01:07.973000Z",
"date_modified": "2026-03-02T18:01:07.973000Z",
"file_hash": "b896acdc7dfb6d021cfc2cfc4d6867c6961dbb93265db239570cf37867bcb8e0",
"private": false,
"record": {
"abstract": "Quantum-mechanical close-coupling calculations for state-to-state cross\nsections and thermal rates are reported for H2+H2 collisions. Two recently\ndeveloped potential energy surfaces (PES) for the H2-H2 system are applied,\nnamely, the global potential surface from the work of A.I. Boothroyd, P.G.\nMartin, W.J. Keogh, M.J. Peterson, J. Chem. Phys., 116 (2002) 666, and a\nrestricted, model surface from the works of P. Diep, J.K. Johnson, J. Chem.\nPhys., 113 (2000) 3480; ibid. 112, 4465. The low temperature limit is\ninvestigated. We found significant differences in cross sections and\ncorresponding thermal rates calculated with these two PESs.",
"arxiv_id": "physics/0605202",
"authors": [
"Renat A. Sultanov",
"Dennis Guster"
],
"categories": [
"physics.chem-ph",
"physics.atm-clus"
],
"doi": "10.1016/j.cplett.2006.07.019",
"title": "Rotational Energy Transfer in H2+H2",
"url": "https://arxiv.org/abs/physics/0605202"
},
"schema_id": "dorsal/arxiv",
"source": {
"execution_id": "0f34f6ca-ca11-45c6-924f-0e0c2a6688c1",
"id": "arXiv Dataset IDs",
"type": "Model",
"variant": "snapshot-2026-03-01",
"version": "0.1.0"
},
"user_id": 1000002
}