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  2. Chemical reaction model - Wikipedia

    en.wikipedia.org/wiki/Chemical_reaction_model

    The laminar finite rate model computes the chemical source terms using the Arrhenius expressions and ignores turbulence fluctuations. This model provides with the exact solution for laminar flames but gives inaccurate solution for turbulent flames, in which turbulence highly affects the chemistry reaction rates, due to highly non-linear Arrhenius chemical kinetics.

  3. List of chemical process simulators - Wikipedia

    en.wikipedia.org/wiki/List_of_chemical_process...

    This is a list of software used to simulate the material and energy balances of chemical process plants. Applications for this include design studies, engineering studies, design audits, debottlenecking studies, control system check-out, process simulation, dynamic simulation, operator training simulators, pipeline management systems, production management systems, digital twins.

  4. Element–reactant–product table - Wikipedia

    en.wikipedia.org/wiki/Element–reactant...

    From this table we see that the number of hydrogen and chlorine atoms on the product's side are twice the number of atoms on the reactant's side. Therefore, we add the coefficient "2" in front of the HCl on the products side, to get the equation to look like this:

  5. Conversion (chemistry) - Wikipedia

    en.wikipedia.org/wiki/Conversion_(chemistry)

    Conversion and its related terms yield and selectivity are important terms in chemical reaction engineering.They are described as ratios of how much of a reactant has reacted (X — conversion, normally between zero and one), how much of a desired product was formed (Y — yield, normally also between zero and one) and how much desired product was formed in ratio to the undesired product(s) (S ...

  6. Reaction mechanism - Wikipedia

    en.wikipedia.org/wiki/Reaction_mechanism

    A complete mechanism must also explain the reason for the reactants and catalyst used, the stereochemistry observed in reactants and products, all products formed and the amount of each. S N 2 reaction mechanism. Note the negatively charged transition state in brackets in which the central carbon atom in question shows five bonds, an unstable ...

  7. Combustion models for CFD - Wikipedia

    en.wikipedia.org/wiki/Combustion_models_for_CFD

    The reactants are assumed to react in stoichiometric proportions. The model also deduces a linear relationship between the mass fractions of fuel, oxidant and the non dimensional variable mixture fraction. [2] The model also takes into account an additional assumption that the mass diffusion coefficients of all species are equal. [3]

  8. Energy profile (chemistry) - Wikipedia

    en.wikipedia.org/wiki/Energy_profile_(chemistry)

    While free energy change describes the stability of products relative to reactants, the rate of any reaction is defined by the energy of the transition state relative to the starting material. Depending on these parameters, a reaction can be favorable or unfavorable, fast or slow and reversible or irreversible, as shown in figure 8.

  9. Continuous stirred-tank reactor - Wikipedia

    en.wikipedia.org/wiki/Continuous_stirred-tank...

    Diagram showing the setup of a continuous stirred-tank reactor. The continuous stirred-tank reactor (CSTR), also known as vat-or backmix reactor, mixed flow reactor (MFR), or a continuous-flow stirred-tank reactor (CFSTR), is a common model for a chemical reactor in chemical engineering and environmental engineering.