Pooja Nema

Species in core is isomorphic to species in the edge

2

### Bug Description I am trying to generate a kinetic mechanism for CH2F2 refrigerant using RMG. After completion of the simulation, I get the following warning (image attached below): Species...

AssertionError during an RMG job run

1

**An error message:** assert spc.name not in phasesys.phases[phase_label].names, spc.name AssertionError: C7H14-2 **Context:** I am trying to generate chemical kinetic model for methylcyclohexane combustion with air using JetSurf2.0 mechanism included in...

`maximumEdgeSpecies` ignored if `toleranceThermoKeepSpeciesInEdge` is not given

9

I am trying to generate a model for propylcyclohexane and air mixture for the equivalence ratio ranging from 0.5-2 with maximumEdgeSpecies value of 10000. But, when I run rmg job...

CH2* replaced by CH2 for a reaction in JetSurf2.0 mechanism

1

Hello Everyone, I am investigating the kinetic behaviour of SAF surrogates using RMG and used the JetSurf2.0 included in the RMG database to generate a mechanism for n-decane combustion in...

InvalidMicrocanonicalRateError

1

Hello Everyone, I am working on kinetic model generation for n-decane combustion in air. Based on the reactor pressure, temperature and mixture composition I intend to produce a mechanism with...

Corrected CH2 & CH2* species for reactions in JetSurF2.0

2

This Pull Request is submitted with reference to the email communication with Prof. Alon Grinberg Dana on issue #649 . The JetSurF2.0 reaction library is corrected for the below reactions:...