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Accessibility information
Author(s):   Cardelino, B.H.; Moore, C.E.; Cardelino, C.A.; McCall, S.D.; Frazier, D.O.; Bachmann, K.J.
Title:   Semiclassical Calculation of Reaction Rate Constants for Homolytical Dissociation Reactions of Interest in Organometallic Vapor-Phase Epitaxy (OMPE)
Journal:   J. Phys. Chem. A
Volume:   107
Page(s):   3708 - 3718
Year:   2003
Comments:   NOTE: The units of the bimolecular reaction rates are never stated. The best fit with experimental data for trhe CH3+CH3 -> C2H6 indicates that this rates are in liter mole/second.
Reference type:   Journal article
Squib:   2003CAR/MOO3708-3718

Reaction:   ·CH3 + In → InCH3(singlet)
Reaction order:   2
Temperature:   700 - 1000 K
Pressure:  20.27 bar
Rate expression:   1.24x10-10 [cm3/molecule s] e-81033 [J/mole]/RT
Category:  Theory
Data type:   Other theoretical
Pressure dependence:   Rate constant is pressure dependent
Comments:   Activation energy is derived from the bond dissociation energy, which was computed using density functional theory.

View full bibliographic record.


Rate constant values calculated from the Arrhenius expression:

T (K)k(T) [cm3/molecule s]
700 1.11E-16
725 1.79E-16
750 2.81E-16
775 4.27E-16
800 6.32E-16
825 9.15E-16
850 1.29E-15
875 1.80E-15
900 2.45E-15
925 3.28E-15
950 4.33E-15
975 5.63E-15
1000 7.23E-15