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Accessibility information
Author(s):   Zhu, R.S.; Lin, M.C.
Title:   Ab Initio Studies of ClOx Reactions: 2. Unimolecular Decomposition of s-ClO3 and the Bimolecular O + OClO Reaction
Journal:   J. Phys. Chem. A
Volume:   106
Page(s):   8386 - 8390
Year:   2002
Reference type:   Journal article
Squib:   2002ZHU/LIN8386-8390

Reaction:   ClO3 → O(3P) + OClO
Reaction order:   1
Temperature:   500 - 2500 K
Rate expression:   2.85x1017 [s-1] (T/298 K)-1.10 e-152654 [J/mole]/RT
Category:  Theory
Data type:   Ab initio
Pressure dependence:   Rate constant is high pressure limit
Comments:   RRKM/Master Equation Calculations

View full bibliographic record.

Rate constant values calculated from the Arrhenius expression:

T (K)k(T) [s-1]
500 1.82E1
600 6.77E3
700 4.52E5
800 1.04E7
900 1.17E8
1000 7.99E8
1100 3.82E9
1200 1.39E10
1300 4.14E10
1400 1.05E11
1500 2.33E11
1600 4.66E11
1700 8.55E11
1800 1.46E12
1900 2.36E12
2000 3.62E12
2100 5.30E12
2200 7.50E12
2300 1.03E13
2400 1.37E13
2500 1.77E13