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Science 26 October 2001:
Vol. 294. no. 5543, pp. 832 - 834
DOI: 10.1126/science.1063774

Reports

Fully State-Resolved Differential Cross Sections for the Inelastic Scattering of the Open-Shell NO Molecule by Ar

Hiroshi Kohguchi,1 Toshinori Suzuki,12* Millard H. Alexander3

State-resolved differential cross sections (DCSs) for the inelastic scattering of NO(j" = 0.5, Omega " = 1/2) + Ar rightarrow  NO(j', Omega ' = 1/2, 3/2) + Ar were obtained at a collision energy of 516 cm-1, both experimentally and theoretically. A crossed molecular beam ion-imaging apparatus was used to measure DCSs for 20 final (j', Omega ') states, including spin-orbit conserving (Delta Omega  = 0) and changing (Delta Omega  = 1) transitions. Quantum close-coupling scattering calculations on ab initio coupled-cluster CCSD(T) and CEPA (correlated electron pair approximation) potential energy surfaces were also performed. Although small discrepancies were found for the Delta Omega  = 1 transitions, we find marked agreement between theory and experiment for the collision dynamics of this system, which is the paradigm for the collisional relaxation of a molecular radical.

1 Institute for Molecular Science and Graduate University for Advanced Studies, Myodaiji, Okazaki 444-8585, Japan.
2 PRESTO, Japan Science and Technology Corporation, Japan.
3 Department of Chemistry and Biochemistry, University of Maryland, College Park, MD 20742-2021, USA.
*   To whom correspondence should be addressed. E-mail: suzuki{at}ims.ac.jp


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THIS ARTICLE HAS BEEN CITED BY OTHER ARTICLES:
Reactive and Nonreactive Scattering of H2 from a Metal Surface Is Electronically Adiabatic.
P. Nieto, E. Pijper, D. Barredo, G. Laurent, R. A. Olsen, E.-J. Baerends, G.-J. Kroes, and D. Farias (2006)
Science 312, 86-89
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Science. ISSN 0036-8075 (print), 1095-9203 (online)