An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules: switching from pure stabilisation to pure decomposition with increasing temperature

Timo T. Pekkanen; Laszlo Valkai; Satya P. Joshi; Gyorgy Lendvay; Petri Heinonen; Raimo S. Timonen; Arkke J. Eskola

doi:10.1039/d2fd00031h

An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules: switching from pure stabilisation to pure decomposition with increasing temperature

Timo T. Pekkanen, Laszlo Valkai, Satya P. Joshi, Gyorgy Lendvay, Petri Heinonen, Raimo S. Timonen, Arkke J. Eskola

Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review

Originalspråk	engelska
Tidskrift	Faraday Discussions
Volym	238
Nummer	0
Sidor (från-till)	619-644
Antal sidor	26
ISSN	1359-6640
DOI	https://doi.org/10.1039/d2fd00031h
Status	Publicerad - 21 okt. 2022
MoE-publikationstyp	A1 Tidskriftsartikel-refererad

Vetenskapsgrenar

116 Kemi

Åtkomst av dokument

10.1039/d2fd00031hLicens: CC BY

d2fd00031hSlutlig publicerad version, 2,77 MBLicens: CC BY
d2fd00031hSlutlig publicerad version, 2,77 MBLicens: CC BY

Citera det här

Pekkanen, T. T., Valkai, L., Joshi, S. P., Lendvay, G., Heinonen, P., Timonen, R. S., & Eskola, A. J. (2022). An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules: switching from pure stabilisation to pure decomposition with increasing temperature. Faraday Discussions, 238(0), 619-644. https://doi.org/10.1039/d2fd00031h

@article{fc297e9f202c41abb4bf535bfd3fd021,

title = "An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules: switching from pure stabilisation to pure decomposition with increasing temperature",

keywords = "BASIS-SET CONVERGENCE, CORRELATED CALCULATIONS, KINETICS, THERMOCHEMISTRY, PARAMETERS, MIXTURES, HYDROGEN, QUALITY, ALLYL, 116 Chemical sciences",

author = "Pekkanen, {Timo T.} and Laszlo Valkai and Joshi, {Satya P.} and Gyorgy Lendvay and Petri Heinonen and Timonen, {Raimo S.} and Eskola, {Arkke J.}",

year = "2022",

month = oct,

day = "21",

doi = "10.1039/d2fd00031h",

language = "English",

volume = "238",

pages = "619--644",

journal = "Faraday Discussions",

issn = "1359-6640",

publisher = "Royal Society of Chemistry",

number = "0",

}

Pekkanen, TT, Valkai, L, Joshi, SP, Lendvay, G, Heinonen, P , Timonen, RS & Eskola, AJ 2022, 'An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules: switching from pure stabilisation to pure decomposition with increasing temperature', Faraday Discussions, vol. 238, nr. 0, s. 619-644. https://doi.org/10.1039/d2fd00031h

An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules : switching from pure stabilisation to pure decomposition with increasing temperature. / Pekkanen, Timo T.; Valkai, Laszlo; Joshi, Satya P. et al.

I: Faraday Discussions, Vol. 238, Nr. 0, 21.10.2022, s. 619-644.

Forskningsoutput: Tidskriftsbidrag › Artikel › Vetenskaplig › Peer review

TY - JOUR

T1 - An experimental and computational study of the reaction between pent-3-en-2-yl radicals and oxygen molecules

T2 - switching from pure stabilisation to pure decomposition with increasing temperature

AU - Pekkanen, Timo T.

AU - Valkai, Laszlo

AU - Joshi, Satya P.

AU - Lendvay, Gyorgy

AU - Heinonen, Petri

AU - Timonen, Raimo S.

AU - Eskola, Arkke J.

PY - 2022/10/21

Y1 - 2022/10/21

KW - BASIS-SET CONVERGENCE

KW - CORRELATED CALCULATIONS

KW - KINETICS

KW - THERMOCHEMISTRY

KW - PARAMETERS

KW - MIXTURES

KW - HYDROGEN

KW - QUALITY

KW - ALLYL

KW - 116 Chemical sciences

U2 - 10.1039/d2fd00031h

DO - 10.1039/d2fd00031h

M3 - Article

VL - 238

SP - 619

EP - 644

JO - Faraday Discussions

JF - Faraday Discussions

SN - 1359-6640

IS - 0

ER -