orderseek - Finds chemical reaction order

Version 1.1.0.0 (1,54 ko) par Brad Ridder
Returns the reaction order, r-squared value, rate constant, and half life.
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Mise à jour 10 fév. 2010

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From undergraduate chemistry, we know how to test whether a reaction is 0th, 1st, or 2nd order by plotting different transformations of the data, and inspecting which plot fits the best.

This program does the same thing. It transforms the data using different values of the order, attempting to maximize the Pearson r-squared value. Its much faster than making and inspecting a multitude of different plots.

The picture above is essentially an example.

I used the Wikipedia article for the n-th order transformation equation. (http://en.wikipedia.org/wiki/Rate_equation#Summary_for_reaction_orders_0.2C_1.2C_2_and_n)

Citation pour cette source

Brad Ridder (2024). orderseek - Finds chemical reaction order (https://www.mathworks.com/matlabcentral/fileexchange/26621-orderseek-finds-chemical-reaction-order), MATLAB Central File Exchange. Récupéré le .

Compatibilité avec les versions de MATLAB
Créé avec R2008b
Compatible avec toutes les versions
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Version Publié le Notes de version
1.1.0.0

fixed a tiny little error in the correlation coefficient's calculation. all better now :)
1.0.0.0