Theoretical study on the scattering resonance states for I+HI(v=0)-> IH(v '=0)+I system
文献类型：期刊论文
| 作者 | Sun, XM; Wang, HY; Cai, ZT; Feng, DC; Bian, WS |
| 刊名 | CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
 |
| 出版日期 | 2004-09-01 |
| 卷号 | 25期号:9页码:1702-1705 |
| 关键词 | Heavy-light-heavy System Partial Potential Energy Surface Scattering Resonance States Ab Initio |
| ISSN号 | 0251-0790 |
| 英文摘要 | The ab initio partial potential energy surface is calculated on QCISD(T)//MP2 level for heavy-light-heavy I+HI(v=0)-->IH(v'=0)+I system. For H and I atom, 6-311+ +G** basis set and SDD basis set including the relativistic effect are used separately. The scattering resonance states are found for the title system and the six scattering resonance states are identified as the Feshbach type in the. collision energy range from 0 to 0.58 eV which are compared with the theoretical results of quantum. scattering and the experimental ones of threshold photodetachment spectroscopy. The partial potential energy surface can reveal effectively the mechanism of the scattering resonance states formation. |
| 语种 | 英语 |
| WOS记录号 | WOS:000224014600029 |
| 出版者 | HIGHER EDUCATION PRESS |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/55499]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Cai, ZT |
| 作者单位 | 1.Shandong Univ, Inst Theoret Chem, Jinan 250100, Peoples R China 2.Chinese Acad Sci, Inst Chem, State Key Lab Mol React Dynam, Beijing 100080, Peoples R China |
| 推荐引用方式 GB/T 7714 | Sun, XM,Wang, HY,Cai, ZT,et al. Theoretical study on the scattering resonance states for I+HI(v=0)-> IH(v '=0)+I system[J]. CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE,2004,25(9):1702-1705. |
| APA | Sun, XM,Wang, HY,Cai, ZT,Feng, DC,&Bian, WS.(2004).Theoretical study on the scattering resonance states for I+HI(v=0)-> IH(v '=0)+I system.CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE,25(9),1702-1705. |
| MLA | Sun, XM,et al."Theoretical study on the scattering resonance states for I+HI(v=0)-> IH(v '=0)+I system".CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE 25.9(2004):1702-1705. |
入库方式： OAI收割
来源：化学研究所
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