国家自然科学基金(s20303007)

作品数：2被引量：0H指数：0
导出分析报告
相关期刊：《Chemical Research in Chinese Universities》更多>>
相关主题：MECHANISMKINETICSHYDROGEN_BONDCHAB_INITIO_CALCULATION更多>>
相关领域：理学化学工程更多>>
-
在结果中检索

检索结果分析

结果分析中...
共 条 记 录，以下是1-2
全选清除导出
参考文献引证文献引用追踪
视图：
排序：
Theoretical Study of CH_3CH=CH_2+O(~1D) Reaction: Mechanism and Kinetics
《Chemical Research in Chinese Universities》2012年第1期147-152,共6页WU Nan-nan, LIU Hong-xia, DUAN Xue-mei and LIU Jing-yao State Key Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical Chemistry, Jilin University, Changchun 130021, P. R. China 
Supported by the National Natural Science Foundation of China(Nos.20303007, 20333050, 20973077);the Program for New Century Excellent Talents(NCET) in Universities of China
The mechanism and kinetics for the reaction of propene（CH3CH=CH2） molecule with O（1D） atom were investigated theoretically. The electronic structure information of the potential energy surface（PES） was obtained ...
关键词：PROPENE O（lD） MECHANISM KINETICS 
Using Raman Spectroscopy and ab initio Calculations to Investigate Intermolecular Hydrogen Bonds in Binary Mixture (Tetrahydrofuran+Water)
《Chemical Research in Chinese Universities》2011年第4期693-696,共4页WU Nan-nan OUYANG Shun-li LI Zuo-wei LIU Jing-yao GAO Shu-qin 
Supported by the National Natural Science Foundation of China(Nos.20303007,20333050,20973077);the Program for New Century Excellent Talents in University,China and the Graduate Innovation Fund of Jilin University,China(No.20101046)
We analyzed the properties and structures of the hydrogen-bonded complexes of tetrahydrofuran（THF） and water by means of experimental Raman spectra and ab initio calculations.The optimized geometries and vibrational...
关键词：Hydrogen bond Raman spectroscopy Ab initio calculation 
全选清除导出
共1页<1>
检索报告 对象比较 聚类工具 使用帮助 返回顶部