Re: [cantera-users] Digest for cantera-users@googlegroups.com - 1 update in 1 topic

[Daniel Thomas]

Hi Richard,

Many reaction mechanisms have been developed for ammonia combustion -- both for carbon-free N/H/O and with methane C/N/H/O.  See below for a table.  I've attached Otomo's in .cti format if you want one to try,

Daniel

Author	Year	Ver	Elements	Fuel	Species	Rxns	Primary Source
Miller & Bowman	1989		H/N/O		19	73	Authors' work
Lindstedt et al.	1994		H/N/O/C1	NH3/H2	21	95	Published data
GRI-Mech. 3.0	2000		H/N/O/C1-C2/Ar		53	325	Gas Research Institute
Konnov et al.	2001	0.5	H/N/O	H2	31	238	Authors' work
Dagaut et al.	2008		H/N/O/C1		41	250	Published mechanisms
Åbo Akademi	2008		H/N/O/C1-C2/Ar	Biofuels	60	371	Previous ÅA work
Konnov	2009	0.6	H/N/O/C1-C3/Ar		129	1236	Authors' work
Mendiara et al.	2009		H/N/O/C1/Ar		97	779	Previous Glarborg work
Tian et al.	2009		H/N/O/C1/Ar		84	703	Skreiberg et al., 2004
Mével	2009		H/N/O/Ar	H2/N2O	32	203	Konnov, Mueller
Klippenstein	2011		H/N/O/C1/Ar		31	202	Miller & Glarborg, 1999
Duynslaegher	2012	Red.	H/N/O	NH3/H2	192	80	Konnov
Mathieu et al.	2015		H/N/O/C1/Ar/He		55	276	Dagaut et al.
Nozari et al.	2015	Red.	H/N/O	NH3/H2	21	91	Konnov
Song et al.	2016		H/N/O/C1/Ar/He	NH3	32	204	Klippenstein et al.
Xiao et al.	2017	Full	H/N/O/C1/Ar/He		55	276	Mathieu et al.
Xiao et al.	2017	Red.	H/N/O/Ar		24	108	Mathieu et al.
Nakamura et al.	2017		H/N/O/C1/Ar/He	NH3	33	232	Miller & Bowman
Shrestha et al.	2018		H/N/O/C1/Ar/He		125	Lots	Lamoureux, 2016
Glarborg et al.	2018		H/N/O/C1/Ar/He	NH3/CH4	151	1397	Authors' work
Otomo, et al.	2018		H/N/O/Ar/He	NH3/H2	32	213	Song et al.
Okafor et al.	2018	Full	H/N/O/C1/Ar	NH3/CH4	59	356	GRI-Mech, Tian
Okafor et al.	2019	Red.	H/N/O/C1/Ar	NH3/CH4	42	130	Okafor et al., 2018
Li, Konnov, et al.	2019	Full	H/N/O/C1	NH3/H2/CH4	128	957	Shrestha, Tian, Aramco
Li, Konnov, et al.	2019	Red.	H/N/O	NH3/H2	28	213	Shrestha, Tian, Aramco

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• Non-catalyzed dissociation of Ammonia - 1 Update

Non-catalyzed dissociation of Ammonia

Richard Colwell <rlcol...@gmail.com>: Mar 05 08:29AM -0800 Has anyone ever made/used a mechanism for the non catalyzed disscociation of ammonia? Or will I probably have to make it myself?

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[ahle...@gmail.com]

Hello,

Do you have the mechanism okafor et al in .cti format please?

Thank you

[Mark E. Fuller]

There is a repo for collecting mechanisms for Cantera. The folder for nitrogen/ammonia combustion is at   CollectionOfMechanisms/Nitrogen at master · jiweiqi/CollectionOfMechanisms (github.com)

Feel free to open a PR to add mechanisms as you come across them