Influence of real gas effects on chemical kinetics in oxycombustion in supercritical carbon dioxide

ORAL

Abstract

Oxycombustion in supercritical carbon dioxide is an integral part of the Allam Cycle, a technology that enables carbon-neutral use of fossil-fuels and carbon-negative use of biofuels. We simulate oxycombustion in a realistic combustor geometry for two sets of fuel conditions: pure methane, and a 40 percent methane/60 percent carbon dioxide blend, both at 343.15 K. The fuel jet mixes with a preheated swirler of 20 percent oxygen and 80 percent carbon dioxide at 1005.35 K, with a 100 percent carbon dioxide coflow at 783.15 K. The entire system operates at a pressure of 300 bar, putting the entire system above the critical temperature and pressure of carbon dioxide. Simulations are performed using PeleC, a compressible block-structured adaptive-mesh refinement (AMR) reacting flow code. Direct comparison of results using thermodynamically self-consistent implementations of the ideal gas equation of state and the Soave-Redlich-Kwong (SRK) equation of state allow quantification of the real gas impacts on combustion kinetics, flow temperatures, and pollutant formation.

*This work was supported by the Exascale Computing Project (17-SC-20-SC), a collaborative effort of two U.S. Department of Energy (DOE) organizations, the Office of Science and the National Nuclear Security Administration. The research was performed using computational resources sponsored by the Department of Energy's Office of Energy Efficiency and Renewable Energy and located at the National Renewable Energy Laboratory. This research also used resources of the Oak Ridge Leadership Computing Facility at the Oak Ridge National Laboratory, which is supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC05-00OR22725.

Presenters

  • Mohammad J Rahimi

    • National Renewable Energy Laboratory

Authors

  • Mohammad J Rahimi

    • National Renewable Energy Laboratory
  • Marc T Henry de Frahan

    • National Renewable Energy Laboratory
  • Olga Doronina

    • National Renewable Energy Laboratory
  • Shashank Yellapantula

    • National Renewable Energy Laboratory
  • Ian Cormier

    • 8 Rivers
  • Marc Day

    • National Renewable Energy Laboratory
  • Michael J Martin

    • National Renewable Energy Laboratory
  • Bruce A Perry

    • National Renewable Energy Laboratory