Reconciling experimental and theoretical vibrational deactivation in low-energy O + N-2 collisions
文献类型:期刊论文
作者 | Hong QZ(洪启臻)5,6![]() ![]() |
刊名 | PHYSICAL CHEMISTRY CHEMICAL PHYSICS
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出版日期 | 2021-06-02 |
卷号 | 23期号:29页码:5 |
关键词 | vibronic transition |
ISSN号 | 1463-9076 |
DOI | 10.1039/d1cp01976g |
英文摘要 | Molecular dynamics calculations of inelastic collisions of atomic oxygen with molecular nitrogen are known to show orders of magnitude discrepancies with experimental results in the range from room temperature to many thousands of degrees Kelvin. In this work, we have achieved an unprecedented quantitative agreement with experiments even at low temperature, by including a non-adiabatic treatment involving vibronic states on newly developed potential energy surfaces. This result paves the way for the calculation of accurate and detailed databases of vibrational energy exchange rates for this collisional system. This is bound to have an impact on air plasma simulations under a wide range of conditions and on the development of Very Low Earth Orbit (VLEO) satellites, operating in the low thermosphere, objects of great technological interest due to their potential at a competitive cost. |
分类号 | 二类/Q1 |
资助项目 | Strategic Priority Research Program of Chinese Academy of Sciences[XDA17030100] ; National Natural Science Foundation of China[11372325] ; National Natural Science Foundation of China[91116013] ; Spanish grant[FIS2017-84391-C2-2-P] |
WOS研究方向 | Chemistry ; Physics |
语种 | 英语 |
WOS记录号 | WOS:000664224800001 |
资助机构 | Strategic Priority Research Program of Chinese Academy of Sciences ; National Natural Science Foundation of China ; Spanish grant |
源URL | [http://dspace.imech.ac.cn/handle/311007/86961] ![]() |
专题 | 力学研究所_高温气体动力学国家重点实验室 |
通讯作者 | Coletti, Cecilia |
作者单位 | 1.Univ Perugia, Dipartimento Chim Biol & Biotecnol, Via Elce di Sotto 8, I-06123 Perugia, Italy 2.Univ G dAnnunzio, Dipartimento Farm, Via Vestini, I-66100 Chieti, Italy 3.CNR, Ist Sci & Tecnol Plasmi, Sede Secondaria Bari, Via Amendola 122-D, I-70126 Bari, Italy 4.CSIC, Inst Fis Fundamental, C Serrano 123, Madrid, Spain 5.Univ Chinese Acad Sci, Sch Engn Sci, Beijing 100049, Peoples R China 6.Chinese Acad Sci, Inst Mech, State Key Lab High Temp Gas Dynam, Beijing 100190, Peoples R China |
推荐引用方式 GB/T 7714 | Hong QZ,Bartolomei, Massimiliano,Esposito, Fabrizio,et al. Reconciling experimental and theoretical vibrational deactivation in low-energy O + N-2 collisions[J]. PHYSICAL CHEMISTRY CHEMICAL PHYSICS,2021,23(29):5. |
APA | Hong QZ,Bartolomei, Massimiliano,Esposito, Fabrizio,Coletti, Cecilia,Sun QH,&Pirani, Fernando.(2021).Reconciling experimental and theoretical vibrational deactivation in low-energy O + N-2 collisions.PHYSICAL CHEMISTRY CHEMICAL PHYSICS,23(29),5. |
MLA | Hong QZ,et al."Reconciling experimental and theoretical vibrational deactivation in low-energy O + N-2 collisions".PHYSICAL CHEMISTRY CHEMICAL PHYSICS 23.29(2021):5. |
入库方式: OAI收割
来源:力学研究所
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