Numerical Simulations of turbulent non-premixed cool flames at supercritical/high pressures: dual peak structure, pressure scaling and real-gas effects

ORAL

Abstract

We present adaptive mesh refinement (AMR)-based 2-D DNS-like simulations of a dimethyl ether (DME)-air temporal turbulent reacting mixing layer with detailed chemistry at 80, 120, and 150 atm. The critical pressure for the fuel mixture obtained from a Vapor-Liquid Equilibrium calculation is 147 atm–indicating mixing occurs between two supercritical gas-like fluids at 150 atm and a subcritical gas-like fuel with a supercritical gas-like oxidizer at 120 and 80 atm. The simulations are performed using both ideal gas and Soave-Redlich-Kwong (SRK) equations of state (EoS) to study real-gas effects. Contours of heat release rate (HRR), temperature, mass fractions of LTC-specific species of DME (e.g., CH3OCH2O2) and CH2O reveal the formation of cool flames that subsequently transition into spotty hot flame kernels. Mixture-fraction conditioned averages of the above quantities exhibit a dual-peak structure due to the unsteady nature of the flow and the presence of multiple temperature-dependent reaction pathways. Deviations in the order of 10-20% are observed between real and ideal gas EoS in predicting temperature and density and up to 30-40% for radical mass fractions at both high-pressure subcritical and supercritical pressures.

*The authors gratefully acknowledge Prof. Graham V. Candler and the Minnesota Supercomputing Institute (MSI) for the computational resources. We also express our gratitude towards Dr. Marc Day, Dr. Lucas Esclapez, Dr. Marc Henry de Frahan, and the PeleC team at the National Renewable Energy Laboratory (NREL) for the timely help and prompt follow-ups over GitHub with regards to troubleshooting. The discussion on cool flames with Dr. Hao Zhao and the discussion on LTC with Mr. Praise Noah Johnson are also appreciated.

Presenters

  • Suo Yang

    • University of Minnesota

Authors

  • Navneeth Srinivasan

    • University of Minnesota
  • Ramachandran Suryanarayan

    • University of Minnesota
  • Hongyuan Zhang

    • University of Minnesota
  • Taaresh S Taneja

    • University of Minnesota
  • Suo Yang

    • University of Minnesota