wiki:public/doc-auto/by_ext/krc/S_mechanismterm
Last modified 3 years ago Last modified on 01/21/16 13:49:10

Input file krc keyword $MECHANISMTERM

Description

TODO: Add description.

Parameters

TODO: Add parameters.

Documentation from doxygen

None.

Used in benchmarks

C/ChemAppCoupling/slow_kin_cap_act_precalc/cmp8.krc

 40:   $MECHANISMTERM ; acid
 41-     -0.299988938  14400 ; log(k_25) Eact_25
   ...
 68:   $MECHANISMTERM ; acid
 69-      -3.19  36100  ; log(k_25) Eact_25
   ...
 99:  ; $MECHANISMTERM ; acid
100-  ;   -0.299988938  14400 ; log(k_25) Eact_25
   ...

C/Engesgaard/2Kin/slow_kin_pqc_krc/pds.krc

 39:   $MECHANISMTERM ; acid
 40-     -0.299988938  14400 ; log(k_25) Eact_25
   ...
 69:   $MECHANISMTERM ; acid
 70-      -3.19  36100  ; log(k_25) Eact_25
   ...

C/Engesgaard/Additional_pqc_output/pds.krc

 40:   $MECHANISMTERM ; acid
 41-      -3.19  36100  ; log(k_25) Eact_25
   ...
 73:  ; $MECHANISMTERM ; acid
 74-  ;   -0.299988938  14400 ; log(k_25) Eact_25
   ...

C/Engesgaard/Kin/fast_kin_pqc_krc/pds.krc

 40:   $MECHANISMTERM ; acid
 41-      -3.19  36100  ; log(k_25) Eact_25
   ...
 73:  ; $MECHANISMTERM ; acid
 74-  ;   -0.299988938  14400 ; log(k_25) Eact_25
   ...

C/Engesgaard/Kin/slow_kin_pqc_krc/pds.krc

 40:   $MECHANISMTERM ; acid
 41-      -3.19  36100  ; log(k_25) Eact_25
   ...
 73:  ; $MECHANISMTERM ; acid
 74-  ;   -0.299988938  14400 ; log(k_25) Eact_25
   ...

Source code reading this keyword from Input files

FEM/rf_kinreact.cpp line 2040

2040: 		    mechvec.push_back(m_mech);
2041:       }
2042:       //....................................................................
2043:       if(line_string.find("$MECHANISMTERM")!=string::npos) { // subkeyword found
2044:         // before reading in k mechanistic species, store ratteconstant and Eact
2045:         m_mech = new MinkinMech();
2046:         number_Mech++;

Last modified: 2016-01-21 13:49:00.020182

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