质谱的准平衡态理论计算方法和应用 |
| |
引用本文: | 蔡元坝,陈振涛,陈宙.质谱的准平衡态理论计算方法和应用[J].结构化学,1988(4). |
| |
作者姓名: | 蔡元坝 陈振涛 陈宙 |
| |
作者单位: | 中国科学院福建物质结构研究所
(蔡元坝,陈振涛),中国科学院福建物质结构研究所(陈宙) |
| |
摘 要: | 本文根据质谱准平衡态理论利用自编的QETC(准平衡态理论计算)程序,对两个化合物(CH_2)_3S和CH_3CH_2CH_3进行计算,得到与实验值符合较好的结果。
|
Quasi- Equilibrium Theoretical Calculation (QETC)of Mass Spectra and Its Application |
| |
Abstract: | A self-edited QETC program (operated in VAX-11/785 computer)has been used for QETC of two Compounds thiacyclobutan and propane. The result's in qualitative or semi-quantitative agreement with the experiment for two compounds were obtained. |
| |
Keywords: | |
本文献已被 CNKI 等数据库收录! |
|