globalchange  > 过去全球变化的重建
DOI: 10.1063/1.5102073
WOS记录号: WOS:000473301400004
论文题名:
Molecular oxygen generation from the reaction of water cations with oxygen atoms
作者: Fortenberry, Ryan C.1; Trabelsi, Tarek2; Westbrook, Brent R.3; Del Rio, Weston A.1; Francisco, Joseph S.2
通讯作者: Fortenberry, Ryan C.
刊名: JOURNAL OF CHEMICAL PHYSICS
ISSN: 0021-9606
EISSN: 1089-7690
出版年: 2019
卷: 150, 期:20
语种: 英语
WOS关键词: OXYWATER
WOS学科分类: Chemistry, Physical ; Physics, Atomic, Molecular & Chemical
WOS研究方向: Chemistry ; Physics
英文摘要:

The oxywater cation (H2OO+), previously shown to form barrierlessly in the gas phase from water cations and atomic oxygen, is proposed here potentially to possess a(2)A" <-(4)A" excitation leading to the H-2 center dot center dot center dot O-2(+) complex. This complex could then easily decompose into molecular hydrogen and the molecular oxygen cation. The present quantum chemical study shows that the necessary electronic transition takes place in the range of 1.92 eV (645 nm), in the orange-red range of the visible and solar spectrum, and dissociation of the complex only requires 5.8 kcal/mol (0.25 eV). Such a process for the abiotic, gas phase formation of O-2 would only need to be photocatalyzed by visible wavelength photons. Hence, such a process could produce O-2 at the mesosphere/stratosphere boundary as climate change is driving more water into the upper atmosphere, in the comet 67P/Churyumov-Gerasimenko where surprisingly high levels of O-2 have been observed, or at gas-surface (ice) interfaces. Published under license by AIP Publishing.


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资源类型: 期刊论文
标识符: http://119.78.100.158/handle/2HF3EXSE/138652
Appears in Collections:过去全球变化的重建

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作者单位: 1.Univ Mississippi, Dept Chem & Biochem, University, MS 38677 USA
2.Univ Penn, Dept Earth & Environm Sci Philadelphia, Philadelphia, PA 19104 USA
3.St Edwards Univ, Dept Chem, Austin, TX 78704 USA

Recommended Citation:
Fortenberry, Ryan C.,Trabelsi, Tarek,Westbrook, Brent R.,et al. Molecular oxygen generation from the reaction of water cations with oxygen atoms[J]. JOURNAL OF CHEMICAL PHYSICS,2019-01-01,150(20)
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