Отрывок: Fig. 1 The C9H7 + O2 reaction pathway leading to the ortho-vinylphenyl radical C8H7 formation: the energies are indicated for both CCSD(T) and G3(MP2,CC) levels of theory. The reaction can proceed by two possible pathways; both of them involve O2 insertion into the 5-membered ring ...
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Поле DC | Значение | Язык |
---|---|---|
dc.contributor.author | Ghildina, A.R. | - |
dc.contributor.author | Mebel, A.M. | - |
dc.contributor.author | Azyazov, V.N. | - |
dc.date.accessioned | 2018-08-14 15:20:28 | - |
dc.date.available | 2018-08-14 15:20:28 | - |
dc.date.issued | 2018 | - |
dc.identifier | Dspace\SGAU\20180813\71358 | ru |
dc.identifier.citation | Ghildina A.R. The rate constants calculations and the potential energy surface for indenyl C9H7 +O2 reaction by ab initio methods / A.R. Ghildina, A.M. Mebel, V.N. Azyazov // International Conference on Combustion Physics and Chemistry // (Samara, Russia, 24-28 July): proceeding of the conference / Samara University; Edited by A.M. Mebel and V.N. Azyazov – Samara: Publishing OOO “Insoma-Press”, 2018 – p. 85 | ru |
dc.identifier.isbn | 978-5-4317-0298-3 | - |
dc.identifier.uri | http://repo.ssau.ru/handle/International-Conference-on-Combustion-Physics-and-Chemistry/The-rate-constants-calculations-and-the-potential-energy-surface-for-indenyl-C9H7-O2-reaction-by-ab-initio-methods-71358 | - |
dc.language.iso | en | ru |
dc.publisher | Publishing OOO “Insoma-Press” | ru |
dc.title | The rate constants calculations and the potential energy surface for indenyl C9H7 +O2 reaction by ab initio methods | ru |
dc.type | Thesis | ru |
dc.textpart | Fig. 1 The C9H7 + O2 reaction pathway leading to the ortho-vinylphenyl radical C8H7 formation: the energies are indicated for both CCSD(T) and G3(MP2,CC) levels of theory. The reaction can proceed by two possible pathways; both of them involve O2 insertion into the 5-membered ring ... | - |
Располагается в коллекциях: | International Conference on Combustion Physics and Chemistry |
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