52 lines
1.2 KiB
YAML
52 lines
1.2 KiB
YAML
phases:
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- name: NaCl(s)
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thermo: fixed-stoichiometry
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species: [NaCl(s)]
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# specification of density was moved to the species object
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state: {T: 300.0, P: 1 atm}
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- name: KCl(s)
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thermo: fixed-stoichiometry
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species: [KCl(s)]
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state: {T: 300.0, P: 1 atm}
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- name: liquid-water
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thermo: water-IAPWS95
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species: [H2O(l)]
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- name: Li-fixed
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thermo: fixed-chemical-potential
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species: [Li]
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chemical-potential: -2.3e7 J/kmol
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species:
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- name: NaCl(s)
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composition: {Na: 1, Cl: 1}
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thermo:
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model: Shomate
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temperature-ranges: [250, 1075]
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data:
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- [50.72389, 6.672267, -2.517167, 10.15934, -0.200675, -427.2115, 130.3973]
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equation-of-state:
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model: constant-volume
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# For constant density, specify either (mass) "density", "molar-density", or
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# "molar-volume"
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density: 2.165 g/cm^3
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- name: KCl(s)
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composition: {K: 1, Cl: 1}
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thermo:
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model: NASA7
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temperature-ranges: [300, 1000]
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data:
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- [5.3934311E+00, 2.6535242E-03, 9.6075655E-07, -5.0251843E-09,
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4.0721228E-12, -5.4248389E+04, -2.1596814E+01]
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equation-of-state:
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model: constant-volume
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molar-volume: 0.0376521717 L/mol
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- name: H2O(l)
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composition: {H: 2, O: 1}
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- name: Li
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composition: {Li: 1}
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