Defining More Forms of Kinetics Data formats

We currently have a Django model for Arrhenius kinetics. However, we need to make the following Kinetics Data formats available as well:

• KineticsData

  • Array of Temp Data
  • Array of rate coefficients
  • Minimum temp
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• ArrheniusEP

  • Pre-exponential factor A
  • Temperature exponent n
  • Evans Polanyi slope alpha
  • Activation energy E0
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• PDepArrhenius

  • List of Pressures
  • List of Arrhenius model instances (ordered to match each pressure)
  • Dictionary of chemical species vs efficiencies
  • Reaction order (???)
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• MultiArrhenius

  • List of Arrhenius model instances
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• MultiPDepArrhenius

  • List of PDepArrhenius model instances
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• Chebyshev

  • Matrix of Chebyshev coefficients
  • Units of the rate coefficient
  • Number of terms in the inverse temperature direction
  • Number of terms in the log pressure direction
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• ThirdBody

  • Arrhenius object at the low pressure limit
  • Dictionary of chemical species vs efficiencies
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• Lindemann

  • Arrhenius object at high limit
  • Arrhenius object at low limit
  • Dictionary of chemical species vs efficiencies
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment

• Troe

  • Arrhenius object at high limit
  • Arrhenius object at low limit
  • alpha
  • T1
  • T2
  • T3
  • Dictionary of chemical species vs efficiencies
  • minimum temperature
  • maximum temperature
  • minimum pressure
  • maximum pressure
  • comment