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题名: Gas-phase reactions of V+ and VO+ with methanol
作者: Cao, YL;  Zhao, X;  Tang, ZC;  Xin, B;  Xiong, SX
关键词: Reactivity ;  FT-ICR mass spectrometer ;  ab initio calculation
刊名: INTERNATIONAL JOURNAL OF MODERN PHYSICS B
发表日期: 2005-07-10
卷: 19, 期:15-17, 页:2693-2698
收录类别: ISTP ;  SCI
文章类型: Article
WOS标题词: Science & Technology ;  Physical Sciences
类目[WOS]: Physics, Applied ;  Physics, Condensed Matter ;  Physics, Mathematical
研究领域[WOS]: Physics
英文摘要: The reactions of V+ and VO+ with methanol have been investigated experimentally by FT-ICR mass spectrometer and theoretically by ab initio calculation. Both V+ and VO+ exhibit impressive reactivity with methanol. The products distribution of different reaction time indicate that in whole reaction processes methanol is adsorbed one by one, and no more than four methanol molecules can be solved in the first shell of central ion V+. The reaction mechanisms have been proposed, and the possible geometrical structures of products are also analyzed by DFT calculations.
关键词[WOS]: OXIDE CLUSTER CATIONS ;  BOND-ENERGIES ;  METAL-IONS ;  VANADIUM ;  OXIDATION ;  M+ ;  CATALYSTS ;  CHEMISTRY ;  ALCOHOLS ;  CO
语种: 英语
WOS记录号: WOS:000231237600014
Citation statistics: 
内容类型: 期刊论文
URI标识: http://cas-ir.dicp.ac.cn/handle/321008/139800
Appears in Collections:中国科学院大连化学物理研究所_期刊论文

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作者单位: 1.Chinese Acad Sci, Inst Chem, State Key Lab Mol React Dynam, Beijing 100080, Peoples R China
2.Chinese Acad Sci, Inst Chem, Ctr Mass Sepctrometry, Beijing 100080, Peoples R China

Recommended Citation:
Cao, YL,Zhao, X,Tang, ZC,et al. Gas-phase reactions of V+ and VO+ with methanol[J]. INTERNATIONAL JOURNAL OF MODERN PHYSICS B,2005,19(15-17):2693-2698.
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