MCM

Complex rate coefficients

The following are complex rate coefficients used in the mechanism. Please refer to this IUPAC Guide for information on how these are defined.

KFPAN: (source: IUPAC 2014 - ROO_14_CH3CO3_NO2_M)
Name	MCM Rate
FCC	$0.30$
KC0	$3.28 \times 10^{- 28} \cdot M \cdot (\frac{T}{300})^{- 6.87}$
KCI	$1.125 \times 10^{- 11} \cdot (\frac{T}{300})^{- 1.105}$
KRC	$\frac{K C 0}{K C I}$
NC	$0.75 - 1.27 \cdot (\log_{10} (FCC))$
FC	$10^{\log_{10} (FCC) / (1 + (\log_{10} (KRC) / NC)^{2})}$
KFPAN	$(KC0 \cdot KCI) \cdot FC / (KC0^{+} KCI)$

KBPAN: (source: IUPAC 2014 - ROO_15_CH3C(O)O2NO2_M)
Name	MCM Rate
FCD	$0.30$
KD0	$1.10 \times 10^{- 05} \cdot M \cdot \exp (\frac{- 10100}{T})$
KDI	$1.90 \times 10^{17} \cdot \exp (\frac{- 14100}{T})$
KRD	$\frac{K D 0}{K D I}$
NCD	$0.75 - 1.27 \cdot (\log_{10} (FCD))$
FD	$10^{\log_{10} (FCD) / (1 + (\log_{10} (KRD) / NCD)^{2})}$
KBPAN	$(KD0 \cdot KDI) \cdot FD / (KD0^{+} KDI)$

KBPPN: (source: IUPAC 2003 - ROO_16_C2H5CO3NO2_M)
Name	MCM Rate
FCPPN	$0.36$
KPPN0	$1.7 \times 10^{- 03} \cdot \exp (\frac{- 11280}{T}) \cdot M$
KPPNI	$8.3 \times 10^{+ 16} \cdot \exp (\frac{- 13940}{T})$
KRPPN	$\frac{K P P N 0}{K P P N I}$
NCPPN	$0.75 - 1.27 \cdot (\log_{10} (FCPPN))$
FPPN	$10^{\log_{10} (FCPPN) / (1 + (\log_{10} (KRPPN) / NCPPN)^{2})}$
KBPPN	$(KPPN0 \cdot KPPNI) \cdot FPPN / (KPPN0^{+} KPPNI)$

KMT01: (source: IUPAC 2012 - NOx1_O_NO)
Name	MCM Rate
FC1	$0.85$
K10	$1.0 \times 10^{- 31} \cdot M \cdot (\frac{T}{300})^{- 1.6}$
K1I	$5.0 \times 10^{- 11} \cdot (\frac{T}{300})^{- 0.3}$
KR1	$\frac{K 10}{K 1 I}$
NC1	$0.75 - 1.27 \cdot (\log_{10} (FC1))$
F1	$10^{\log_{10} (FC1) / (1 + (\log_{10} (KR1) / NC1)^{2})}$
KMT01	$(K10 \cdot K1I) \cdot F1 / (K10^{+} K1I)$

KMT02: (source: IUPAC 2005 - NOx3_O_NO2_M)
Name	MCM Rate
FC2	$0.6$
K20	$1.3 \times 10^{- 31} \cdot M \cdot (\frac{T}{300})^{- 1.5}$
K2I	$2.3 \times 10^{- 11} \cdot (\frac{T}{300})^{0.24}$
KR2	$\frac{K 20}{K 2 I}$
NC2	$0.75 - 1.27 \cdot (\log_{10} (FC2))$
F2	$10^{\log_{10} (FC2) / (1 + (\log_{10} (KR2) / NC2)^{2})}$
KMT02	$(K20 \cdot K2I) \cdot F2 / (K20^{+} K2I)$

KMT03: (source: IUPAC 2012 - NOx31_NO2_NO3)
Name	MCM Rate
FC3	$0.35$
K30	$3.6 \times 10^{- 30} \cdot M \cdot (\frac{T}{300})^{- 4.1}$
K3I	$1.9 \times 10^{- 12} \cdot (\frac{T}{300})^{0.2}$
KR3	$\frac{K 30}{K 3 I}$
NC3	$0.75 - 1.27 \cdot (\log_{10} (FC3))$
F3	$10^{\log_{10} (FC3) / (1 + (\log_{10} (KR3) / NC3)^{2})}$
KMT03	$(K30 \cdot K3I) \cdot F3 / (K30^{+} K3I)$

KMT04: (source: IUPAC 2012 - NOx32_N2O5)
Name	MCM Rate
FC4	$0.35$
K40	$1.3 \times 10^{- 3} \cdot M \cdot (\frac{T}{300})^{- 3.5} \cdot \exp (\frac{- 11000}{T})$
K4I	$9.7 \times 10^{+ 14} \cdot (\frac{T}{300})^{0.1} \cdot \exp (\frac{- 11080}{T})$
KR4	$\frac{K 40}{K 4 I}$
NC4	$0.75 - 1.27 \cdot (\log_{10} (FC4))$
F4	$10^{\log_{10} (FC4) / (1 + (\log_{10} (KR4) / NC4)^{2})}$
KMT04	$(K40 \cdot K4I) \cdot F4 / (K40^{+} K4I)$

KMT05: (source: IUPAC 2005 - HOx_VOC10_HO_CO)
Name	MCM Rate
KMT05	$1.44 \times 10^{- 13} \cdot (1 + (\frac{M}{4.2 \times 10^{+ 19}}))$

KMT06: (source: IUPAC 2001 - HOx14_2HO2_(M))
Name	MCM Rate
KMT06	$1 + (1.40 \times 10^{- 21} \cdot \exp (\frac{2200}{T}) \cdot H2O)$

KMT07: (source: IUPAC 2012 - NOx12_HO_NO)
Name	MCM Rate
FC7	$0.81$
K70	$7.4 \times 10^{- 31} \cdot M \cdot (\frac{T}{300})^{- 2.4}$
K7I	$3.3 \times 10^{- 11} \cdot (\frac{T}{300})^{- 0.3}$
KR7	$\frac{K 70}{K 7 I}$
NC7	$0.75 - 1.27 \cdot (\log_{10} (FC7))$
F7	$10^{\log_{10} (FC7) / (1 + (\log_{10} (KR7) / NC7)^{2})}$
KMT07	$(K70 \cdot K7I) \cdot F7 / (K70^{+} K7I)$

KMT08: (source: IUPAC 2012 - NOx13_HO_NO2)
Name	MCM Rate
FC8	$0.41$
K80	$3.2 \times 10^{- 30} \cdot M \cdot (\frac{T}{300})^{- 4.5}$
K8I	$3.0 \times 10^{- 11}$
KR8	$\frac{K 80}{K 8 I}$
NC8	$0.75 - 1.27 \cdot (\log_{10} (FC8))$
F8	$10^{\log_{10} (FC8) / (1 + (\log_{10} (KR8) / NC8)^{2})}$
KMT08	$(K80 \cdot K8I) \cdot F8 / (K80^{+} K8I)$

KMT09: (source: IUPAC 2012 - NOx16_HO2_NO2)
Name	MCM Rate
FC9	$0.4$
K90	$1.4 \times 10^{- 31} \cdot M \cdot (\frac{T}{300})^{- 3.1}$
K9I	$4.0 \times 10^{- 12}$
KR9	$\frac{K 90}{K 9 I}$
NC9	$0.75 - 1.27 \cdot (\log_{10} (FC9))$
F9	$10^{\log_{10} (FC9) / (1 + (\log_{10} (KR9) / NC9)^{2})}$
KMT09	$(K90 \cdot K9I) \cdot F9 / (K90^{+} K9I)$

KMT10: (source: IUPAC 2012 - NOx17_HO2NO2)
Name	MCM Rate
FC10	$0.4$
K100	$4.10 \times 10^{- 05} \cdot M \cdot \exp (\frac{- 10650}{T})$
K10I	$6.0 \times 10^{+ 15} \cdot \exp (\frac{- 11170}{T})$
KR10	$\frac{K 100}{K 10 I}$
NC10	$0.75 - 1.27 \cdot (\log_{10} (FC10))$
F10	$10^{\log_{10} (FC10) / (1 + (\log_{10} (KR10) / NC10)^{2})}$
KMT10	$(K100 \cdot K10I) \cdot F10 / (K100^{+} K10I)$

KMT11: (source: IUPAC 2007 - NOx10_HO_HONO2)
Name	MCM Rate
K3	$6.50 \times 10^{- 34} \cdot \exp (\frac{1335}{T})$
K4	$2.70 \times 10^{- 17} \cdot \exp (\frac{2199}{T})$
K1	$2.40 \times 10^{- 14} \cdot \exp (\frac{460}{T})$
K2	$(K3 \cdot M) / (1 + (K3 \cdot \frac{M}{K 4}))$
KMT11	$K1 + K2$

KMT12: (source: IUPAC 2012 - SOx15_HO_SO2_M)
Name	MCM Rate
FC12	$0.53$
K120	$2.5 \times 10^{- 31} \cdot M \cdot (\frac{T}{300})^{- 2.6}$
K12I	$2.0 \times 10^{- 12}$
KR12	$\frac{K 120}{K 12 I}$
NC12	$0.75 - 1.27 \cdot (\log_{10} (FC12))$
F12	$10^{\log_{10} (FC12) / (1.0 + (\log_{10} (KR12) / NC12)^{2})}$
KMT12	$(K120 \cdot K12I \cdot F12) / (K120^{+} K12I)$

KMT13: (source: IUPAC 2003 - ROO_9_CH3O2_NO2_M)
Name	MCM Rate
FC13	$0.36$
K130	$2.5 \times 10^{- 30} \cdot M \cdot (\frac{T}{300})^{- 5.5}$
K13I	$1.8 \times 10^{- 11}$
KR13	$\frac{K 130}{K 13 I}$
NC13	$0.75 - 1.27 \cdot (\log_{10} (FC13))$
F13	$10^{\log_{10} (FC13) / (1 + (\log_{10} (KR13) / NC13)^{2})}$
KMT13	$(K130 \cdot K13I) \cdot F13 / (K130^{+} K13I)$

KMT14: (source: IUPAC 2003 - ROO_10_CH3O2NO2_M)
Name	MCM Rate
FC14	$0.36$
K140	$9.0 \times 10^{- 5} \cdot \exp (\frac{- 9690}{T}) \cdot M$
K14I	$1.1 \times 10^{+ 16} \cdot \exp (\frac{- 10560}{T})$
KR14	$\frac{K 140}{K 14 I}$
NC14	$0.75 - 1.27 \cdot (\log_{10} (FC14))$
F14	$10^{\log_{10} (FC14) / (1 + (\log_{10} (KR14) / NC14)^{2})}$
KMT14	$(K140 \cdot K14I) \cdot F14 / (K140^{+} K14I)$

KMT15: (source: IUPAC 2005 - HOx_VOC3_HO_C2H4_M)
Name	MCM Rate
FC15	$0.48$
K150	$8.6 \times 10^{- 29} \cdot M \cdot (\frac{T}{300})^{- 3.1}$
K15I	$9.0 \times 10^{- 12} \cdot (\frac{T}{300})^{- 0.85}$
KR15	$\frac{K 150}{K 15 I}$
NC15	$0.75 - 1.27 \cdot (\log_{10} (FC15))$
F15	$10^{\log_{10} (FC15) / (1 + (\log_{10} (KR15) / NC15)^{2})}$
KMT15	$(K150 \cdot K15I) \cdot F15 / (K150^{+} K15I)$

KMT16: (source: IUPAC 2005 - HOx_VOC5_HO_C3H6_M)
Name	MCM Rate
FC16	$0.5$
K160	$8 \times 10^{- 27} \cdot M \cdot (\frac{T}{300})^{- 3.5}$
K16I	$3.0 \times 10^{- 11} \cdot (\frac{T}{300})^{- 1}$
KR16	$\frac{K 160}{K 16 I}$
NC16	$0.75 - 1.27 \cdot (\log_{10} (FC16))$
F16	$10^{\log_{10} (FC16) / (1 + (\log_{10} (KR16) / NC16)^{2})}$
KMT16	$(K160 \cdot K16I) \cdot F16 / (K160^{+} K16I)$

KMT17: (source: MCM 2005 - HOx_VOC2_HO_C2H2_M)
Name	MCM Rate
FC17	$0.17 \cdot \exp (\frac{- 51}{T})^{+} \exp (\frac{- T}{204})$
K170	$5.0 \times 10^{- 30} \cdot M \cdot (\frac{T}{300})^{- 1.5}$
K17I	$1.0 \times 10^{- 12}$
KR17	$\frac{K 170}{K 17 I}$
NC17	$0.75 - 1.27 \cdot (\log_{10} (FC17))$
F17	$10^{\log_{10} (FC17) / (1.0 + (\log_{10} (KR17) / NC17)^{2})}$
KMT17	$(K170 \cdot K17I \cdot F17) / (K170^{+} K17I)$

KMT18: (source: IUPAC 2006 - SOx22_HO_CH3SCH3)
Name	MCM Rate
KMT18	$9.5 \times 10^{- 39} \cdot O2 \cdot \exp (\frac{5270}{T}) / (1 + 7.5 \times 10^{- 29} \cdot O2 \cdot \exp (\frac{5610}{T}))$