Cantera 3.0.0 Cantera 2.6.0 Cantera 2.5.1 Cantera 2.4.0 Cantera 2.3.0 Cantera 2.2.1 Cantera 2.1.2 Cantera 2.0.2 Science Reference Thermodynamic Properties Species Thermodynamic Models Phase Thermodynamic Models Chemical Reactions Reaction Rates
This pages provide detailed reference documentation for Cantera. Programming Reference# These sections document the classes and functions that define the Cantera interface for
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One-Dimensional Flames. ¶. Cantera includes a set of models for representing steady-state, quasi-one- dimensional reacting flows. These models can be used to simulate a number of common flames, such as: freely-propagating premixed laminar flames. burner-stabilized premixed flames. counterflow diffusion flames.
You'll find documentation for (almost) every function in Cantera right here. This is the documentation for the current stable release, Cantera 3.0.0. For other versions, see the
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Reactors ¶. A Cantera Reactor() represents the simplest form of a chemically reacting system. It corresponds to an extensive thermodynamic control volume V V, in which all state variables are homogeneously distributed. The system is generally unsteady -- that is, all states are functions of time. In particular, transient state changes due to
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Cantera is an open-source suite of tools for problems involving chemical kinetics, thermodynamics, and transport processes. Automation. Cantera automates the chemical
P r = k 0 [ M] k ∞. The rate constant may be written as. k f ( T, P r) = k ∞ ( P r 1 + P r) More accurate models for unimolecular processes lead to other, more complex, forms for the dependence on reduced pressure. These can be accounted for by multiplying the Lindemann expression by a function F ( T, P r): k f ( T, P r) = k ∞ ( P r 1 + P
A three-body reaction is a gas-phase reaction of the form: \mathrm {A + B + M \rightleftharpoons AB + M} A+ B+M ⇌ AB+ M. Here \mathrm {M} M is an unspecified collision partner that carries away excess energy to stabilize the \mathrm {AB} AB molecule (forward direction) or supplies energy to break the \mathrm {AB} AB bond (reverse
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This guide describes how to write such files to define phases and interfaces for use in Cantera simulations. See also. See the Introduction to YAML Input Files for an
In this section, we describe how Cantera uses species and phase information to calculate thermodynamic properties. Thermodynamic properties typically depend on information at both the species and phase levels. Generally, the species thermodynamic model and accompanying coefficient data specifies how the reference enthalpy and entropy values
Mechanism reduction. #. A simplistic approach to mechanism reduction which demonstrates Cantera’s features for dynamically manipulating chemical mechanisms. Here, we use the full GRI 3.0 mechanism to simulate adiabatic, constant pressure ignition of a lean methane/air mixture. We track the maximum reaction rates for each reaction to determine
Cantera is an open-source collection of object-oriented software tools for problems involving chemical kinetics, thermodynamics, and transport processes. Among other things, it can be used to: Cantera can be used from Python and Matlab, or in applications written in C++ and Fortran 90. A number of examples of Cantera's capabilities are
Many of Cantera’s phase thermodynamic models are formulated to make use of the standard state thermodynamic properties for individual species, defined at a standard
Reactors and Reactor Networks. #. In Cantera, a reactor network represents a set of one or more homogeneous reactors and reacting surfaces that may be connected to each other and to the environment through devices representing mass flow, heat transfer, and moving walls. The system is generally unsteady – that is, all states are functions of time.
Introductory Tutorials #. For those new to Cantera, we present here a set of short tutorials to familiarize you with Cantera’s basic functionality and capabilities, give some examples of how to work Cantera within your preferred interface language, and demonstrate some basic troubleshooting. Getting Started with Python.
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Instances of class Kinetics are responsible for evaluating reaction rates of progress, species production rates, and other quantities pertaining to a reaction mechanism. Add a new reaction to this phase. Creation rates for each species. [kmol/m^3/s] for bulk phases or [kmol/m^2/s] for surface phases.
For those new to Cantera, we present here a set of short tutorials to familiarize you with Cantera's basic functionality and basic capabilities, give some examples of how to work Cantera within your preferred interface language—basic function calls and a few simple applications—and demonstrate some basic troubleshooting. After installing
Setting up a Reactor Network #. First, let’s take a look at a basic example to see how we might utilize Cantera’s time integration functionality. We’ll simulate an isolated reactor in Python that is filled with a homogeneous gas mixture. The gas state used in this example is arbitrary, but interesting because it’s explosive.
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