A Python thermophysical property and chemical-equilibrium library for fluids, gases, propellants, combustion products, and engineering materials.
Project description
ThermoProp
ThermoProp is a Python thermophysical-property and chemical-equilibrium library for engineering analysis, propulsion, thermodynamics, heat transfer, and fluid-system modeling.
It provides a unified API for:
- Real fluids
- Fluid mixtures
- Ideal gases
- Ideal-gas mixtures
- Rocket propellants
- Combustion-product gases
- CEA-style reactant mixtures
- Chemical-equilibrium calculations
- Isotropic engineering materials
ThermoProp integrates several thermodynamic and engineering-property sources behind a consistent interface:
- CoolProp
- PYroMat
- RocketProps
- NASA CEA / CEAM thermochemical and transport databases
- Built-in species and material databases
Installation
pip install thermoprop
ThermoProp requires Python 3.11 or newer.
Why ThermoProp?
Engineering projects often need several different property libraries at the same time.
For example, one propulsion or thermal-fluid model may need:
- CoolProp for real-fluid thermodynamics
- PYroMat for ideal-gas thermodynamics
- RocketProps for liquid propellant properties
- NASA CEA data for combustion products
- Material property curves for structural or thermal analysis
- Chemical equilibrium for combustion calculations
Each backend has its own syntax, naming conventions, supported properties, and reference states.
ThermoProp provides a common interface.
Instead of writing backend-specific calls such as:
CP.PropsSI(...)
pm.get(...)
get_prop(...)
you can write:
from thermoprop import Fluid
water = Fluid(
"water",
pressure=101325,
temperature=300,
)
print(water.density)
print(water.enthalpy)
print(water.entropy)
The same general style is used across real fluids, ideal gases, propellants, combustion gases, equilibrium products, and materials.
Wrapper Selection Guide
| Need | Use |
|---|---|
| Real-fluid thermodynamics | Fluid |
| CoolProp fluid mixtures | Fluid |
| Ideal-gas thermodynamics | IdealGas |
| Ideal-gas mixtures | IdealGas |
| Rocket propellant properties | Propellant |
| CEA gas species properties | CombustionGas |
| Combustion-product gas mixtures | CombustionGas |
| Reactant mixture setup | Reactants |
| Chemical equilibrium | Equilibrium |
| Frozen combustion-gas properties | CombustionGas |
| Equilibrium combustion-gas properties | Equilibrium |
| Engineering material properties | Material |
| Direct NASA CEA data access | CEA |
| Species discovery and backend mapping | SpeciesDatabase |
| Material discovery and aliases | MaterialDatabase |
Main Imports
from thermoprop import Fluid
from thermoprop import IdealGas
from thermoprop import Propellant
from thermoprop import CombustionGas
from thermoprop import Reactants
from thermoprop import Equilibrium
from thermoprop import Material
from thermoprop import CEA
from thermoprop import SpeciesDatabase
from thermoprop import MaterialDatabase
ThermoProp also exposes convenience functions:
from thermoprop import species
from thermoprop import supported_species
from thermoprop import species_aliases
from thermoprop import add_species_alias
from thermoprop import materials
from thermoprop import supported_materials
from thermoprop import material_aliases
from thermoprop import add_material_alias
Quick Start
Real Fluid
from thermoprop import Fluid
water = Fluid(
"water",
pressure=101325,
temperature=300,
)
print(water.density)
print(water.enthalpy)
print(water.phase)
Ideal Gas
from thermoprop import IdealGas
nitrogen = IdealGas(
"gn2",
pressure=101325,
temperature=300,
)
print(nitrogen.density)
print(nitrogen.specific_heat_cp)
print(nitrogen.specific_heat_ratio)
print(nitrogen.speed_of_sound)
Liquid Propellant
from thermoprop import Propellant
rp1 = Propellant(
"rp1",
temperature=293.15,
pressure=2.0e6,
)
print(rp1.density)
print(rp1.dynamic_viscosity)
print(rp1.enthalpy)
Combustion Gas
from thermoprop import CombustionGas
gas = CombustionGas(
{
"CO2": 0.25,
"H2O": 0.45,
"CO": 0.10,
"H2": 0.05,
"N2": 0.15,
},
basis="mole",
pressure=2.0e6,
temperature=3200.0,
)
print(gas.density)
print(gas.specific_heat_cp)
print(gas.specific_heat_ratio)
print(gas.dynamic_viscosity)
print(gas.thermal_conductivity)
Reactants and Equilibrium
from thermoprop import Propellant
from thermoprop import Reactants
from thermoprop import Equilibrium
fuel = Propellant(
"RP-1",
temperature=298.15,
pressure=2.0e6,
)
oxidizer = Propellant(
"LOX",
temperature=90.17,
pressure=2.0e6,
)
reactants = Reactants(
fuels=[fuel],
oxidizers=[oxidizer],
mixture_ratio=2.5,
)
eq = Equilibrium(
reactants,
mode="hp",
pressure=2.0e6,
)
print(eq.temperature)
print(eq.mole_fractions)
print(eq.specific_heat_cp)
print(eq.speed_of_sound)
Engineering Material
from thermoprop import Material
inconel = Material(
"in718",
temperature=300,
)
print(inconel.density)
print(inconel.yield_strength)
print(inconel.thermal_conductivity)
Core Wrappers
Fluid
Fluid is a CoolProp-backed real-fluid wrapper.
It supports pure fluids and mixtures using a Fluid-like API with SI units.
Constructor
Fluid(
fluid,
basis="mass",
pressure=None,
enthalpy=None,
temperature=None,
quality=None,
density=None,
internal_energy=None,
)
fluid may be either a string or a dictionary of fractions.
Fluid("water", pressure=101325, temperature=300)
Fluid(
{"nitrogen": 0.79, "oxygen": 0.21},
basis="mole",
pressure=101325,
temperature=300,
)
Supported flash inputs
Fluid requires exactly two thermodynamic state inputs.
Supported pairs include:
pressure+temperaturepressure+enthalpypressure+qualitytemperature+qualitydensity+internal_energypressure+densitypressure+internal_energytemperature+densitydensity+enthalpytemperature+enthalpy
You can inspect supported inputs programmatically:
from thermoprop import Fluid
print(Fluid.supported_flash_inputs())
Common properties
print(fluid.pressure)
print(fluid.temperature)
print(fluid.density)
print(fluid.specific_volume)
print(fluid.enthalpy)
print(fluid.internal_energy)
print(fluid.entropy)
print(fluid.specific_heat_cp)
print(fluid.specific_heat_cv)
print(fluid.specific_heat_ratio)
print(fluid.dynamic_viscosity)
print(fluid.kinematic_viscosity)
print(fluid.thermal_conductivity)
print(fluid.prandtl)
print(fluid.speed_of_sound)
print(fluid.phase)
print(fluid.quality)
Advanced properties
When supported by CoolProp, Fluid also exposes:
- Thermal expansion coefficient
- Isothermal compressibility
- Helmholtz energy
- Gibbs energy
- Fundamental derivative of gas dynamics
- Fugacity coefficients
- Critical properties
- Saturation properties
- Triple-point properties
- First partial derivatives
Example:
water = Fluid("water", pressure=101325, temperature=300)
print(water.thermal_expansion_coefficient)
print(water.isothermal_compressibility)
print(water.gibbs_energy)
print(water.dhdT_const_p)
Updating state
water.pressure_temperature = (2.0e5, 350.0)
water.pressure_enthalpy = (2.0e5, 1.5e6)
water.pressure_quality = (101325, 0.5)
Mixture composition updates
air = Fluid(
{"nitrogen": 0.79, "oxygen": 0.21},
basis="mole",
pressure=101325,
temperature=300,
)
air.mole_fractions = [0.78, 0.22]
Fractions must be finite, nonnegative, and sum to 1.
IdealGas
IdealGas is a PYroMat-backed ideal-gas wrapper with additional transport-property support.
Thermodynamic properties are evaluated using PYroMat. Transport properties use NASA CEA / CEAM transport data when available, with fallback correlations where implemented.
Constructor
IdealGas(
fluid,
basis="mass",
pressure=None,
enthalpy=None,
temperature=None,
internal_energy=None,
density=None,
quality=None,
)
fluid may be either a string or a mixture dictionary.
from thermoprop import IdealGas
air = IdealGas(
"air",
pressure=101325,
temperature=300,
)
gas = IdealGas(
{"nitrogen": 0.79, "oxygen": 0.21},
basis="mole",
pressure=101325,
temperature=300,
)
Supported flash inputs
IdealGas supports thermal states from:
temperatureenthalpyinternal_energy
It also supports density closure using:
pressure+densitypressure+temperaturepressure+enthalpypressure+internal_energydensity+temperaturedensity+enthalpydensity+internal_energy
Example:
gas = IdealGas(
"nitrogen",
pressure=101325,
density=1.14,
)
Pressure-dependent properties
Pressure is optional for some ideal-gas properties.
Pressure is required for properties such as:
- Density
- Entropy
- Gibbs energy
- Helmholtz energy
- Partial pressures
- Some partial derivatives
Common properties
print(gas.temperature)
print(gas.pressure)
print(gas.density)
print(gas.enthalpy)
print(gas.internal_energy)
print(gas.entropy)
print(gas.specific_heat_cp)
print(gas.specific_heat_cv)
print(gas.specific_heat_ratio)
print(gas.dynamic_viscosity)
print(gas.thermal_conductivity)
print(gas.prandtl)
print(gas.speed_of_sound)
State updates
gas.temperature = 500
gas.pressure = 2.0e5
gas.pressure_temperature = (101325, 300)
gas.pressure_enthalpy = (101325, gas.enthalpy)
gas.pressure_internal_energy = (101325, gas.internal_energy)
gas.pressure_density = (101325, 1.2)
Backward-compatible aliases are also available:
gas.TP = (300, 101325)
gas.HP = (gas.enthalpy, 101325)
Mixture composition updates
gas = IdealGas(
{"nitrogen": 0.79, "oxygen": 0.21},
basis="mole",
pressure=101325,
temperature=300,
)
gas.mole_fractions = [0.80, 0.20]
gas.mass_fractions = list(gas.mass_fractions.values())
Composition changes re-flash the gas using the last supplied state inputs.
CombustionGas
CombustionGas is a NASA CEA / CEAM ideal-gas wrapper for gas-phase CEA species and mixtures.
It evaluates thermodynamic properties using NASA-9 CEA polynomials and transport properties using CEA / CEAM transport data when available.
CEA-style fallback estimates are used when explicit transport data are unavailable.
Constructor
CombustionGas(
fluid,
basis="mass",
pressure=None,
enthalpy=None,
temperature=None,
internal_energy=None,
density=None,
quality=None,
)
fluid may be a pure gas species:
from thermoprop import CombustionGas
water_vapor = CombustionGas(
"H2O",
pressure=101325,
temperature=1000,
)
or a gas mixture:
gas = CombustionGas(
{
"CO2": 0.30,
"H2O": 0.50,
"CO": 0.10,
"H2": 0.10,
},
basis="mole",
pressure=2.0e6,
temperature=3000,
)
Supported flash inputs
CombustionGas supports the same style of ideal-gas state inputs as IdealGas:
temperatureenthalpyinternal_energypressure+densitypressure+temperaturepressure+enthalpypressure+internal_energydensity+temperaturedensity+enthalpydensity+internal_energy
Example:
gas = CombustionGas(
{"CO2": 0.4, "H2O": 0.6},
basis="mole",
pressure=2.0e6,
enthalpy=-8.0e6,
)
Common properties
print(gas.temperature)
print(gas.pressure)
print(gas.density)
print(gas.enthalpy)
print(gas.internal_energy)
print(gas.entropy)
print(gas.specific_heat_cp)
print(gas.specific_heat_cv)
print(gas.specific_heat_ratio)
print(gas.dynamic_viscosity)
print(gas.kinematic_viscosity)
print(gas.thermal_conductivity)
print(gas.prandtl)
print(gas.speed_of_sound)
print(gas.mole_fractions)
print(gas.mass_fractions)
Composition updates
gas = CombustionGas(
{"CO2": 0.4, "H2O": 0.6},
basis="mole",
pressure=2.0e6,
temperature=3000,
)
gas.mole_fractions = [0.35, 0.65]
Fractions must be finite, nonnegative, and sum to 1.
Estimated transport data
Some CEA species may not have explicit transport coefficients.
You can inspect which species used estimated transport data:
print(gas.estimated_transport_species)
Propellant
Propellant is a combined RocketProps / NASA CEA wrapper for rocket propellants and CEA reactants.
It resolves names through SpeciesDatabase.
Depending on the propellant and phase, it may use:
- RocketProps liquid-property correlations
- NASA CEA reference data
- NASA CEA condensed-species thermodynamics
- NASA CEA gas-species thermodynamics
Constructor
Propellant(
propellant,
temperature,
pressure=None,
)
Example:
from thermoprop import Propellant
lox = Propellant(
"LOX",
temperature=90.17,
pressure=2.0e6,
)
print(lox.density)
print(lox.enthalpy)
print(lox.elemental_composition)
Supported state inputs
Propellant supports:
temperaturepressure+temperature
rp1 = Propellant("RP-1", temperature=298.15)
lox = Propellant("LOX", temperature=90.17, pressure=2.0e6)
Common properties
Depending on backend availability, Propellant can expose:
- Density
- Specific volume
- Dynamic viscosity
- Kinematic viscosity
- Thermal conductivity
- Surface tension
- Vapor pressure
- Saturation temperature
- Heat of vaporization
- Critical pressure
- Critical temperature
- Critical density
- Enthalpy
- Internal energy
- Entropy
- Standard entropy
- Specific heat
- Molecular weight
- Gas constant
- Heat of formation
- Elemental composition
- CEA polynomial temperature range
- Backend source tracking
Example:
rp1 = Propellant("RP-1", temperature=298.15, pressure=2.0e6)
print(rp1.density)
print(rp1.specific_heat_cp)
print(rp1.enthalpy)
print(rp1.heat_of_formation)
print(rp1.data_sources)
Source tracking
Propellant can report which backend supplied an evaluated property:
print(rp1.data_sources)
print(rp1.property_source("density"))
This is useful because some properties come from RocketProps while others come from NASA CEA.
Phase behavior
For RocketProps-backed species, liquid states are generally evaluated using RocketProps correlations. When pressure falls below vapor pressure and a compatible CEA gas species is available, ThermoProp can use the gas-phase CEA species for thermodynamic data.
Reactants
Reactants defines CEA-style reactant mixtures for equilibrium calculations.
Inputs are Propellant objects grouped into fuels and oxidizers.
Optional weights inside each group are treated as mass weights, similar to CEA weight-percent behavior.
Constructor
Reactants(
fuels,
oxidizers,
mixture_ratio,
)
The total basis is:
fuel mass = 1 kg
oxidizer mass = O/F kg
total mass = 1 + O/F kg
Single-fuel / single-oxidizer example
from thermoprop import Propellant
from thermoprop import Reactants
fuel = Propellant("RP-1", temperature=298.15, pressure=2.0e6)
oxidizer = Propellant("LOX", temperature=90.17, pressure=2.0e6)
reactants = Reactants(
fuels=[fuel],
oxidizers=[oxidizer],
mixture_ratio=2.5,
)
print(reactants.mass_fractions)
print(reactants.mole_fractions)
print(reactants.element_moles_per_kg)
print(reactants.reactant_enthalpy)
Weighted multi-propellant example
from thermoprop import Propellant
from thermoprop import Reactants
fuel_a = Propellant("RP-1", temperature=298.15, pressure=2.0e6)
fuel_b = Propellant("Methane", temperature=111.0, pressure=2.0e6)
oxidizer = Propellant("LOX", temperature=90.17, pressure=2.0e6)
reactants = Reactants(
fuels=[
(fuel_a, 0.8),
(fuel_b, 0.2),
],
oxidizers=[oxidizer],
mixture_ratio=2.7,
)
Common properties
print(reactants.fuel_mass)
print(reactants.oxidizer_mass)
print(reactants.oxidizer_to_fuel_ratio)
print(reactants.total_mass)
print(reactants.mass_fractions)
print(reactants.mole_fractions)
print(reactants.element_moles)
print(reactants.element_moles_per_kg)
print(reactants.reactant_enthalpy)
print(reactants.reactant_internal_energy)
Equilibrium
Equilibrium performs CEA-style chemical-equilibrium calculations using Gibbs free-energy minimization and NASA CEA thermochemical data.
It can solve from:
ReactantsCombustionGas
Constructor
Equilibrium(
reactants,
mode="hp",
temperature=None,
pressure=None,
guess_temperature=3500.0,
candidates=None,
include_all_valid_gases=True,
verbose=False,
element_tol=1e-8,
enthalpy_tol=1e-3,
correction_tol=1e-8,
max_iterations=200,
trace_moles=1e-300,
min_temperature=200.0,
max_temperature=20000.0,
combustion_gas_trace=1e-8,
combustion_gas_max_species=25,
equilibrium_derivative_temperature_step=1.0,
)
HP equilibrium
HP equilibrium uses reactant enthalpy and pressure.
eq = Equilibrium(
reactants,
mode="hp",
pressure=2.0e6,
guess_temperature=3500.0,
)
print(eq.temperature)
print(eq.mole_fractions)
TP equilibrium
TP equilibrium uses specified temperature and pressure.
eq = Equilibrium(
reactants,
mode="tp",
pressure=2.0e6,
temperature=3500.0,
)
print(eq.mole_fractions)
Equilibrium from an existing combustion gas
from thermoprop import CombustionGas
from thermoprop import Equilibrium
gas = CombustionGas(
{"CO2": 0.4, "H2O": 0.6},
basis="mole",
pressure=2.0e6,
temperature=3000.0,
)
eq = Equilibrium(
gas,
mode="tp",
pressure=2.0e6,
temperature=3000.0,
)
Common properties
print(eq.success)
print(eq.message)
print(eq.iterations)
print(eq.temperature)
print(eq.pressure)
print(eq.density)
print(eq.mole_fractions)
print(eq.mass_fractions)
print(eq.normalized_mole_fractions)
print(eq.normalized_mass_fractions)
print(eq.enthalpy)
print(eq.internal_energy)
print(eq.entropy)
print(eq.specific_heat_cp)
print(eq.specific_heat_cp_frozen)
print(eq.specific_heat_cp_equilibrium)
print(eq.specific_heat_ratio)
print(eq.specific_heat_ratio_frozen)
print(eq.specific_heat_ratio_equilibrium)
print(eq.speed_of_sound)
print(eq.speed_of_sound_frozen)
print(eq.speed_of_sound_equilibrium)
print(eq.dynamic_viscosity)
print(eq.thermal_conductivity)
print(eq.prandtl)
CombustionGas output
Equilibrium can generate a CombustionGas object from its equilibrium composition.
gas = eq.combustion_gas
print(gas.specific_heat_cp)
print(gas.dynamic_viscosity)
print(gas.thermal_conductivity)
You can control trace-species filtering:
composition = eq.combustion_gas_composition(
trace=1e-8,
max_species=25,
)
Frozen vs equilibrium properties
Equilibrium distinguishes between frozen-composition and equilibrium-composition properties.
Examples:
print(eq.specific_heat_cp_frozen)
print(eq.specific_heat_cp_equilibrium)
print(eq.specific_heat_ratio_frozen)
print(eq.specific_heat_ratio_equilibrium)
print(eq.speed_of_sound_frozen)
print(eq.speed_of_sound_equilibrium)
print(eq.conductivity_frozen)
print(eq.conductivity_reaction)
print(eq.conductivity_equilibrium)
This is useful for propulsion and nozzle calculations where frozen and shifting-equilibrium assumptions may give different results.
Material
Material provides temperature-dependent isotropic engineering material properties from ThermoProp's built-in material database.
Constructor
Material(
material,
temperature=298.15,
allow_extrapolation=True,
)
Example:
from thermoprop import Material
copper = Material(
"c101",
temperature=300,
)
print(copper.density)
print(copper.thermal_conductivity)
Supported properties
Depending on the material, available properties may include:
- Density
- Specific volume
- Yield strength
- Ultimate strength
- Tensile strength
- Elastic modulus
- Young's modulus
- Torsional modulus
- Shear modulus
- Poisson ratio
- Thermal conductivity
- Specific heat
- Coefficient of thermal expansion
- Thermal diffusivity
- Melting point
- Freezing temperature
- Electrical resistivity
Property lookup
mat = Material("in718", temperature=300)
print(mat.yield_strength)
print(mat.thermal_conductivity)
print(mat.get("yield_strength", temperature=900))
print(mat.units("yield_strength"))
print(mat.temperature_range("yield_strength"))
Curve access
T, y = mat.curve("yield_strength")
State update
mat.temperature = 900
print(mat.yield_strength)
or:
mat.set_state(temperature=900)
Available materials
from thermoprop import materials
print(materials())
Built-In Databases
SpeciesDatabase
SpeciesDatabase is ThermoProp's unified species-name and backend-mapping database.
It maps ThermoProp species names to backend-specific names for:
- CoolProp
- PYroMat
- NASA CEA
- RocketProps
Use it indirectly through wrappers or directly for discovery.
from thermoprop import species
from thermoprop import supported_species
from thermoprop import species_aliases
print(species())
print(supported_species("Fluid"))
print(supported_species("IdealGas"))
print(supported_species("Propellant"))
print(supported_species("CombustionGas"))
print(species_aliases())
Runtime species aliases
from thermoprop import add_species_alias
from thermoprop import Fluid
add_species_alias("my-water", "Water")
water = Fluid(
"my-water",
pressure=101325,
temperature=300,
)
Convenience aliases are also available:
from thermoprop import aliases
from thermoprop import add_alias
print(aliases())
add_alias("my-air", "Air")
MaterialDatabase
MaterialDatabase stores material identity records, aliases, metadata, and temperature-dependent property curves.
Use it directly or through Material.
from thermoprop import materials
from thermoprop import material_aliases
from thermoprop import add_material_alias
print(materials())
print(material_aliases())
add_material_alias("chamber-alloy", "Inconel 718")
CEA
CEA is a package-level instance of CEADatabase.
It provides direct access to parsed NASA CEA / CEAM thermochemical and transport data.
Discovery
from thermoprop import CEA
print(CEA.names)
print(CEA.gas_species)
print(CEA.condensed_species)
print(CEA.reactant_names)
print(CEA.transport_names)
Search
print(CEA.find_species("H2O"))
print(CEA.find_transport_species("CO2"))
Species data
print(CEA.molecular_weight("CO2"))
print(CEA.molar_mass("CO2"))
print(CEA.elemental_composition("CO2"))
print(CEA.temperature_ranges("CO2"))
Thermodynamic properties
cp, h, s0 = CEA.thermo_molar("CO2", 3000.0)
print(cp)
print(h)
print(s0)
Mass-specific helpers are also available:
print(CEA.cp_mass("CO2", 3000.0))
print(CEA.enthalpy_mass("CO2", 3000.0))
print(CEA.entropy_mass_standard("CO2", 3000.0))
Transport properties
print(CEA.viscosity("CO2", 1000.0))
print(CEA.conductivity("CO2", 1000.0))
Mixture helpers
x = [0.7, 0.3]
species_names = ["CO2", "H2O"]
w = CEA.mole_to_mass(species_names, x)
print(w)
x2 = CEA.mass_to_mole(species_names, w)
print(x2)
Combustion Workflow
ThermoProp separates combustion setup, equilibrium solving, and product-property evaluation.
Propellant -> Reactants -> Equilibrium -> CombustionGas
Step 1: Define propellant states
from thermoprop import Propellant
fuel = Propellant(
"RP-1",
temperature=298.15,
pressure=2.0e6,
)
oxidizer = Propellant(
"LOX",
temperature=90.17,
pressure=2.0e6,
)
Step 2: Build reactants
from thermoprop import Reactants
reactants = Reactants(
fuels=[fuel],
oxidizers=[oxidizer],
mixture_ratio=2.5,
)
Step 3: Solve equilibrium
from thermoprop import Equilibrium
eq = Equilibrium(
reactants,
mode="hp",
pressure=2.0e6,
)
Step 4: Evaluate gas properties
gas = eq.combustion_gas
print(eq.temperature)
print(eq.mole_fractions)
print(gas.specific_heat_cp)
print(gas.dynamic_viscosity)
Property Discovery
Most wrappers expose property and flash-input discovery methods.
Supported properties
from thermoprop import Fluid
from thermoprop import IdealGas
from thermoprop import CombustionGas
from thermoprop import Propellant
from thermoprop import Material
from thermoprop import Equilibrium
print(Fluid.supported_properties())
print(IdealGas.supported_properties())
print(CombustionGas.supported_properties())
print(Propellant.supported_properties())
print(Material.supported_properties())
print(Equilibrium.supported_properties())
Supported flash inputs
print(Fluid.supported_flash_inputs())
print(IdealGas.supported_flash_inputs())
print(CombustionGas.supported_flash_inputs())
print(Propellant.supported_flash_inputs())
print(Material.supported_flash_inputs())
print(Equilibrium.supported_flash_inputs())
Available species
print(Fluid.get_available_fluids())
print(IdealGas.get_available_gases())
print(CombustionGas.get_available_species())
print(Propellant.get_available_propellants())
Available materials
print(Material.get_available_materials())
print(Material.get_available_properties())
Thermodynamic Reference States
ThermoProp provides a unified API across multiple thermodynamic backends.
However, the underlying libraries and databases may use different thermodynamic reference states.
This affects absolute values of:
- Enthalpy
- Internal energy
- Entropy
- Gibbs energy
- Helmholtz energy
For example, a CoolProp Fluid, a PYroMat IdealGas, a NASA CEA CombustionGas, and a RocketProps / CEA Propellant may report different absolute enthalpy values even for physically similar states.
This is expected.
Within a single backend, property differences are generally meaningful:
- Delta enthalpy
- Delta internal energy
- Delta entropy
- Heat capacity
- Density
- Speed of sound
- Transport properties
When combining results from multiple wrappers, establish a consistent thermodynamic reference basis if absolute values are required.
Units
ThermoProp's public API uses SI units.
Common units include:
| Quantity | Unit |
|---|---|
| Pressure | Pa |
| Temperature | K |
| Density | kg/m³ |
| Specific volume | m³/kg |
| Enthalpy | J/kg |
| Internal energy | J/kg |
| Entropy | J/kg-K |
| Specific heat | J/kg-K |
| Dynamic viscosity | Pa-s |
| Kinematic viscosity | m²/s |
| Thermal conductivity | W/m-K |
| Surface tension | N/m |
| Molar mass | kg/mol |
| Molecular weight | kg/kmol, numerically equal to g/mol |
| Material strength | Pa |
Limitations
General
ThermoProp wraps and combines several independent property sources.
Property availability depends on:
- The selected wrapper
- The selected species or material
- Backend support
- Temperature range
- Pressure range
- Phase
- Availability of NASA CEA transport data
Use runtime introspection methods such as supported_properties(), supported_flash_inputs(), and data_sources where available.
Fluid
Fluid is limited by CoolProp support.
Limitations include:
- Supported fluids are limited to CoolProp-compatible fluids.
- Mixture behavior follows CoolProp capabilities and limitations.
- Some advanced properties may be unavailable for some fluids or states.
- Two-phase and mixture flashes may be backend-limited.
IdealGas
IdealGas assumes ideal-gas behavior.
Limitations include:
- Not intended for dense gases.
- Not intended for near-critical states.
- Not a real-fluid equation-of-state wrapper.
- Transport-property availability depends on CEA data or fallback correlations.
- Absolute thermodynamic reference states follow PYroMat conventions.
CombustionGas
CombustionGas uses gas-phase NASA CEA species.
Limitations include:
- Only gas-phase CEA product species are accepted.
- Condensed species and CEA reactant cards are not valid
CombustionGasspecies. - It does not solve chemical equilibrium by itself.
- Use
Equilibriumwhen product composition should be determined from reactants. - Transport data may be estimated for species without explicit CEAM transport fits.
- Temperature must remain within the common valid NASA polynomial range for the selected species.
Propellant
Propellant combines RocketProps and NASA CEA data.
Limitations include:
- Property availability depends on backend support for the selected species.
- RocketProps-backed properties are primarily liquid engineering correlations.
- CEA-backed properties depend on available CEA species, reactant, or condensed-phase entries.
- Not every propellant has all thermodynamic, transport, reference, or critical properties.
- Mixture propellants are only supported where the underlying backend supports them.
Reactants
Reactants is a reactant-mixture definition object.
Limitations include:
- Inputs must be
Propellantobjects. - Fuels and oxidizers are grouped separately.
- Mixture ratio is oxidizer-to-fuel mass ratio.
- Reactant enthalpy and elemental composition require valid propellant thermochemical data.
Equilibrium
Equilibrium assumes chemical equilibrium.
Limitations include:
- Does not model finite-rate chemistry.
- Does not model transient reaction kinetics.
- Does not model mixing, diffusion, ignition delay, or combustion instability.
- Results depend on the selected candidate product species.
- HP equilibrium uses the reactant enthalpy basis supplied by the input reactants.
- Condensed product phases are not currently treated as full equilibrium products in the gas-product solver.
Material
Material provides temperature-dependent isotropic property curves.
Limitations include:
- No anisotropic material support.
- No composite material support.
- No pressure dependence.
- No stress-strain curves.
- No creep modeling.
- No fatigue data.
- No fracture-mechanics data.
- No plasticity model.
- Property values are interpolated from stored curves or constants.
Documentation
Full documentation:
https://saakethramoju.github.io/softwares/thermoprop/
Source code:
https://github.com/saakethramoju/ThermoProp
PyPI:
https://pypi.org/project/thermoprop/
Acknowledgments
ThermoProp incorporates, depends on, or adapts data from:
- CoolProp
- PYroMat
- RocketProps
- NASA CEA / CEAM
- MatProtLib
- NumPy
- SciPy
ThermoProp's engineering material database was adapted from material property data compiled and distributed through the MatProtLib project.
Special thanks to Tyson Tran and the MatProtLib project for making engineering material datasets publicly available.
The author also gratefully acknowledges the NASA Glenn Research Center and the NASA CEA development team for making thermochemical and transport datasets publicly available.
License
ThermoProp is released under the GNU General Public License v3.0.
See:
LICENSETHIRD_PARTY_LICENSES.md
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