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This set was fitted with a πd(A−Bχ) model, with A and B fitting parameters, and the resulting fit used to 'reconstruct' the interface energies from ReaxFF simulations.
Figure 4 Magnitude and phase plots of the measured system transfer function ( (pmb{h omega)}) ) and the function fit used for the simulation.
The Tauc plots, (α hν 1/12 versus hν, of selected samples are reported with symbols in Figure 4b, while lines are the linear fit used to determine B and E opt g.
The simulations and analysis below were performed using R. We follow Clauset et al [14] in using the Kolmogorov-Smirnov (KS) test, a non-parametric test of goodness of fit, used for assessing the probability that a sample of observations was drawn from a given population distribution (whether empirically measured or mathematically generated).
The kinetic data in the manuscript now all include a plot of the fit used to determine the rate constant.
The results are assessed according to the same measures of model fit used for the CFA[ 24].
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Perform a fit using current optimization method and fit statistic.
All models were fit using a Gaussian likelihood.
The background was fit using a Chebyshev polynomial and the diffraction peaks were fit using a pseudo-Voigt profile function.
Models were fit using PROC GLIMMIX in SAS.
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