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  2. Rate equation - Wikipedia

    en.wikipedia.org/wiki/Rate_equation

    For a typical second-order reaction with rate equation = [] [], if the concentration of reactant B is constant then = [] [] = ′ [], where the pseudo–first-order rate constant ′ = []. The second-order rate equation has been reduced to a pseudo–first-order rate equation, which makes the treatment to obtain an integrated rate equation much ...

  3. Rate-determining step - Wikipedia

    en.wikipedia.org/wiki/Rate-determining_step

    In fact, however, the observed reaction rate is second-order in NO 2 and zero-order in CO, [5] with rate equation r = k[NO 2] 2. This suggests that the rate is determined by a step in which two NO 2 molecules react, with the CO molecule entering at another, faster, step. A possible mechanism in two elementary steps that explains the rate ...

  4. Effective molarity - Wikipedia

    en.wikipedia.org/wiki/Effective_molarity

    In chemistry, the effective molarity (denoted EM) [1] is defined as the ratio between the first-order rate constant of an intramolecular reaction and the second-order rate constant of the corresponding intermolecular reaction (kinetic effective molarity) [1] [2] or the ratio between the equilibrium constant of an intramolecular reaction and the equilibrium constant of the corresponding ...

  5. Thiele modulus - Wikipedia

    en.wikipedia.org/wiki/Thiele_modulus

    Then the Thiele modulus for a first order reaction is: = From this relation it is evident that with large values of , the rate term dominates and the reaction is fast, while slow diffusion limits the overall rate. Smaller values of the Thiele modulus represent slow reactions with fast diffusion.

  6. Lindemann mechanism - Wikipedia

    en.wikipedia.org/wiki/Lindemann_mechanism

    The steady-state rate equation is of mixed order and predicts that a unimolecular reaction can be of either first or second order, depending on which of the two terms in the denominator is larger. At sufficiently low pressures, k − 1 [ M ] ≪ k 2 {\displaystyle k_{-1}[{\ce {M}}]\ll k_{2}} so that d [ P ] / d t = k 1 [ A ] [ M ...

  7. Order of accuracy - Wikipedia

    en.wikipedia.org/wiki/Order_of_accuracy

    Consider , the exact solution to a differential equation in an appropriate normed space (, | | | |). Consider a numerical approximation u h {\displaystyle u_{h}} , where h {\displaystyle h} is a parameter characterizing the approximation, such as the step size in a finite difference scheme or the diameter of the cells in a finite element method .

  8. MUSCL scheme - Wikipedia

    en.wikipedia.org/wiki/MUSCL_scheme

    In this paper he constructed the first high-order, total variation diminishing (TVD) scheme where he obtained second order spatial accuracy. The idea is to replace the piecewise constant approximation of Godunov's scheme by reconstructed states, derived from cell-averaged states obtained from the previous time-step. For each cell, slope limited ...

  9. Hyperpolarizability - Wikipedia

    en.wikipedia.org/wiki/Hyperpolarizability

    where the coefficients χ (n) are the n-th-order susceptibilities of the medium, and the presence of such a term is generally referred to as an n-th-order nonlinearity. In isotropic media () is zero for even n, and is a scalar for odd n. In general, χ (n) is an (n + 1)-th-rank tensor. It is natural to perform the same expansion for the non ...