Seeking Assistance on Reaction Mechanism using RMG #2857
Description
Topic
General area which your question is related to.
- Installation of RMG
- Running an RMG job
- Using RMG API
- Arkane (formerly CanTherm)
- Dependencies
- An error message
Context
In one of my research projects, I am working on cellular automata model development for a microwave-driven polypropylene upcycling process. The polypropylene converts into propylene, C4H8, C4H10, C3H8, C2H4, C2H6, CH4, H2, Benzene, Toluene, and Xylene. I am trying to find the underlying reaction mechanisms and estimate reaction kinetics parameters from polypropylene raw material to these product distributions. I came to learn about RMG software, and I do not know how to utilize it to discover the reaction mechanisms.
Question
Could you please provide me with insights on how I should start to benefit from this software? Are there any tutorials for beginners? Any guidance would be much appreciated.
Thank you very much.
Installation Information
Describe your installation method and system information if applicable.
- OS (include version if known): (e.g. Windows 10, Ubuntu 18, macOS 10.13, etc.)
- Installation method: (e.g. installation from binary or source, with or without anaconda)
- RMG version information:
- RMG-Py:
- RMG-database: