Examples

Chapman

Top Level Config

Download yaml ZIP Download json ZIP

YAML

version: 1.0.0
name: Chapman
species:
- name: M
  is third body: true
- name: O2
- name: O
- name: O1D
- name: O3
  molecular weight [kg mol-1]: 0.048
  __long name: ozone
  __atoms: 3
  __do advect: true
phases:
- name: gas
  species:
  - name: M
  - name: O
  - name: O2
  - name: O3
  - name: O1D
reactions:
  - type: PHOTOLYSIS
    gas phase: gas
    name: jO2->O(3P)
    scaling factor: 1
    reactants:
      - species name: O2
    products:
      - species name: O
        coefficient: 2

  - type: PHOTOLYSIS
    gas phase: gas
    name: jO3->O(1D)
    scaling factor: 1
    reactants:
      - species name: O3
    products:
      - species name: O1D
      - species name: O2

  - type: PHOTOLYSIS
    gas phase: gas
    name: jO3->O(3P)
    scaling factor: 1
    reactants:
      - species name: O3
    products:
      - species name: O
      - species name: O2

  - type: ARRHENIUS
    gas phase: gas
    name: O1D + M -> O + M
    A: 1.29476e7
    Ea: -1.518e-21
    B: 0
    D: 300
    E: 0
    reactants:
      - species name: O1D
      - species name: M
    products:
      - species name: O
      - species name: M

  - type: ARRHENIUS
    gas phase: gas
    name: O1D + O2 -> O + O2
    A: 1.98731e7
    Ea: -7.59e-22
    B: 0
    D: 300
    E: 0
    reactants:
      - species name: O1D
      - species name: O2
    products:
      - species name: O
      - species name: O2

  - type: ARRHENIUS
    gas phase: gas
    name: O + O3 -> 2 O2
    A: 4.81771e6
    Ea: 2.8428e-20
    B: 0
    D: 300
    E: 0
    reactants:
      - species name: O
      - species name: O3
    products:
      - species name: O2
        coefficient: 2

  - type: ARRHENIUS
    gas phase: gas
    name: O + O2 + M -> O3 + M
    A: 2.17597e2
    Ea: 0
    B: -2.4
    D: 300
    E: 0
    reactants:
      - species name: O
      - species name: O2
      - species name: M
    products:
      - species name: O3
      - species name: M

JSON

{
  "version": "1.0.0",
  "name": "Chapman",
  "species": [
    {
      "name": "M",
      "is third body": true,
    },
    {
      "name": "O2"
    },
    {
      "name": "O"
    },
    {
      "name": "O1D"
    },
    {
      "name": "O3",
      "molecular weight [kg mol-1]": 0.048,
      "__long name": "ozone",
      "__atoms": 3,
      "__do advect": true
    }
  ],
  "phases": [
    {
      "name": "gas",
      "species": [
        { "name": "M"},
        { "name": "O"},
        { "name": "O2"},
        { "name": "O3"},
        { "name": "O1D"}
      ]
    }
  ],
  "reactions": [
     {
      "type": "PHOTOLYSIS",
      "name": "jO2->O(3P)",
      "scaling factor": 1,
      "gas phase": "gas",
      "reactants": [
        { "species name": "O2" }
      ],
      "products": [
        { "species name": "O", "coefficient": 2 }
      ]
    },
    {
      "type": "PHOTOLYSIS",
      "name": "jO3->O(1D)",
      "scaling factor": 1,
      "gas phase": "gas",
      "reactants": [
        { "species name": "O3" }
      ],
      "products": [
        { "species name": "O1D" },
        { "species name": "O2" }
      ]
    },
    {
      "gas phase": "gas",
      "type": "PHOTOLYSIS",
      "name": "jO3->O(3P)",
      "scaling factor": 1,
      "reactants": [
        { "species name": "O3" }
      ],
      "products": [
        { "species name": "O" },
        { "species name": "O2" }
      ]
    },
    {
      "gas phase": "gas",
      "type": "ARRHENIUS",
      "name": "O1D + M -> O + M",
      "A": 1.29476e7,
      "Ea": -1.518e-21,
      "B": 0,
      "D": 300,
      "E": 0,
      "reactants": [
        { "species name": "O1D" },
        { "species name": "M" }
      ],
      "products": [
        { "species name": "O" },
        { "species name": "M" }
      ]
    },
    {
      "gas phase": "gas",
      "type": "ARRHENIUS",
      "name": "O1D + O2 -> O + O2",
      "A": 1.98731e7,
      "Ea": -7.59e-22,
      "B": 0,
      "D": 300,
      "E": 0,
      "reactants": [
        { "species name": "O1D" },
        { "species name": "O2" }
      ],
      "products": [
        { "species name": "O" },
        { "species name": "O2" }
      ]
    },
    {
      "gas phase": "gas",
      "type": "ARRHENIUS",
      "name": "O + O3 -> 2 O2",
      "A": 4.81771e6,
      "Ea": 2.8428e-20,
      "B": 0,
      "D": 300,
      "E": 0,
      "reactants": [
        { "species name": "O" },
        { "species name": "O3" }
      ],
      "products": [
        { "species name": "O2", "coefficient": 2 }
      ]
    },
    {
      "gas phase": "gas",
      "type": "ARRHENIUS",
      "name": "O + O2 + M -> O3 + M",
      "A": 2.17597e2,
      "Ea": 0,
      "B": -2.4,
      "D": 300,
      "E": 0,
      "reactants": [
        { "species name": "O" },
        { "species name": "O2" },
        { "species name": "M" }
      ],
      "products": [
        { "species name": "O3" },
        { "species name": "M" }
      ]
    }
  ]
}