%0 Journal Article
%T The effect of the attractive well of the potential energy surface for Ne--HCl on rotationally inelastic partial wave cross sections<br>The effect of the attractive well of the potential energy surface for Ne-HC1 on rotationally inelastic partial wave cross sections
%A Yu Chun-Ri
%A Shi Shou-Hu
%A Wang Rong-Kai
%A Yang Xiang-Dong
%A <br>余春日
%A 史守华
%A 汪荣凯
%A 杨向东
%J 中国物理 B
%D 2007
%I 
%X An interaction potential of the Ne-HC1 van der Waals complex is obtained by utilizing the Huxley analytic potential function to fit the accurate interaction energy data, which have been computed at the coupled cluster singles and doubles including connected triple excitations level and with the augmented correlation consistent polarized valence quintuple zeta basis set extended with a set of 3s3p2dlflg mid-bond functions CCSD （T）/aug-cc-pV5Z-33211]. The close coupling calculation of state-to-state partial cross sections for collision of Ne with HC1 is first performed by employing the fitted interaction potential. This calculation is performed at the incident energies： 40, 60, 75 and 100 meV, separately. The effects of the long-range attractive and the short-range anisotropic interactions on the inelastic state-to-state partial cross sections are discussed in detail. Two maxima are present in the rotationally inelastic partial cross sections and they originate from different mechanisms.第一段]
%K potential energy surface
%K inelastic partial wave cross sections
%K close-coupling approach
%K Ne-HC1 complex<br>能量表面
%K 无弹性局部波
%K 交叉面
%K 逼近
%U http://www.alljournals.cn/get_abstract_url.aspx?pcid=6E709DC38FA1D09A4B578DD0906875B5B44D4D294832BB8E&cid=47EA7CFDDEBB28E0&jid=CD8D6A6897B9334F09D8D1648C376FB4&aid=51EC29F0F1FE47968DE0D317C588EF51&yid=A732AF04DDA03BB3&vid=7801E6FC5AE9020C&iid=708DD6B15D2464E8&sid=D3D464E0F6BEA0B6&eid=92B3DB2D430ED648&journal_id=1009-1963&journal_name=中国物理&referenced_num=0&reference_num=0