Author(s):   Dash, M. R.; Rajakumar, B.
Title:   Abstraction and addition kinetics of C2H radicals with CH4, C2H6, C3H8, C2H4, and C3H6: CVT/SCT/ISPE and hybrid meta-DFT methods
Journal:   Phys. Chem. Chem. Phys.
Volume:   17
Page(s):   3142 - 3156
Year:   2015
Reference type:   Journal article
Squib:   2015DAS/RAJ3142-3156

Associated entries:

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Rate expression: k(T) = A (T/298 K)ⁿ e^-Ea/RT
Rate expression units:
First order: s^-1
Second order: cm³/molecule s
Third order: cm⁶/molecule² s
R = 8.314472 J / mole K

Energy Units	J	Molecular Units	Molecule
Pressure Units	bar	Temperature Units	K
Base Volume Unit	cm	Reference Temperature	298.0
Evaluation Temperature	298.0

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Squib	Reaction	Temp [K]	A	n	Ea [J/mole]	k(298.00 K)	Order
2015DAS/RAJ3142-3156	CH₄ + ·C₂H → C₂H₂ + ·CH₃	150 - 5000	5.11E-13	2.44	-2752	1.55E-12	2
2015DAS/RAJ3142-3156	C₂H₆ + ·C₂H → C₂H₂ + ·C₂H₅	150 - 5000	7.13E-12	2.11	-3592	3.04E-11	2
2015DAS/RAJ3142-3156	C₃H₈ + ·C₂H → Other Products + C₂H₂	150 - 5000	3.81E-12	1.98	-5795	3.95E-11	2
2015DAS/RAJ3142-3156	C₂H₄ + ·C₂H → Products	150 - 5000	1.59E-13	2.96	-1.61E04	1.07E-10	2
2015DAS/RAJ3142-3156	CH₃CH=CH₂ + ·C₂H → Products	150 - 5000	2.61E-14	3.44	-2.50E04	6.38E-10	2

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