Perhaps the best way to learn the input file syntax is by example. To that end, a number of example input files and their corresponding output have been given in the examples
directory. Two of the RMG jobs are shown below.
This is the minimal example file characterizing a very basic system for ethane pyrolysis and should run quickly if RMG is set up properly. It does not include any calculation of pressure-dependent reaction rates.
../../../../examples/rmg/minimal/input.py
This example models the pyrolysis of 1,3-hexadiene and demonstrates the effect of turning on the pressure-dependence module within RMG.
../../../../examples/rmg/1,3-hexadiene/input.py
This is a fully commented input file with all optional blocks for new users to better understand the options of rmg input files
../../../../examples/rmg/commented/input.py