liqiang4567

How to convert chemkin files to kinetics library(without dictionary.txt files)

1

Hello: I only have the chemkin file now and want to convert it to a dynamics library for the RMG seed mechanism. RMG has a script importChemkinLibrary.py to convert, but...

Error: Invalid k(E) values computed for path reaction "[CH2]C(CC=C)C1C=C=CC1(5521) <=> C=CCC1CC2[C]=CC1C2(6089)". Error: Increasing number of grains did not decrease error enough (Current badness: 0.3, previous 0.3).

2

Hello, when I used RMG 3.1.0 to calculate heptane-eg5 in the example, the following error occurred, how can I solve it? The input files and some of the output files...

Error: Model Resurrection has failed

1

Hello, when I used RMG 3.1.0 generation mechanism, I used an already completed mechanism as a seed mechanism to generate a new mechanism, an error occurred as follows, how can...

ValueError:invalid literal for int() with base 10: '\n'

1

Hello, I encountered such an error when running the RMG.3.1.0 code, how to solve it: The File "/ home/XXX/anaconda3 / envs/rmg_latest/lib/python3.7 / site - packages/rmgpy/data/base. Py", line 1386, in load_entry...

`arkane` unable to infer molecular weights with pdep

10

### Topic General area which your question is related to. - [ ] Arkane (formerly CanTherm) ### Question I want to obtain the pressure-dependent rate coefficients of C2H2 + C5H5...