Interaction of NH(X 3Σ-) with He:: Potential energy surface, bound states, and collisional Zeeman relaxation -: art. no. 094307

被引:70
作者
Cybulski, H [1 ]
Krems, RV
Sadeghpour, HR
Dalgarno, A
Klos, J
Groenenboom, GC
van der Avoird, A
Zgid, D
Chalasinski, G
机构
[1] Warsaw Univ, Dept Chem, PL-02093 Warsaw, Poland
[2] Univ Nijmegen, Inst Theoret Chem, NSRIM, NL-6525 ED Nijmegen, Netherlands
[3] Harvard Smithsonian Ctr Astrophys, Inst Theoret Atom & Mol Phys, Cambridge, MA 02138 USA
[4] Oakland Univ, Dept Chem, Rochester, MI 48309 USA
基金
美国国家科学基金会;
关键词
D O I
10.1063/1.1857473
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A detailed analysis of the He-NH((3)Sigma(-)) van der Waals complex is presented. We discuss ab initio calculations of the potential energy surface and fitting procedures with relevance to cold collisions, and we present accurate calculations of bound energy levels of the triatomic complex as well as collisional properties of NH molecules in a buffer gas of He-3. The influence of the external magnetic field used to trap the NH molecules and the effect of the atom-molecule interaction potential on the collisionally induced Zeeman relaxation are explored. It is shown that minute variations of the interaction potential due to different fitting procedures may alter the Zeeman relaxation rate at ultralow temperatures by as much as 50%. (C) 2005 American Institute of Physics.
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页数:8
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