The product of 2Z generally approximates the value of ma of atoms that comprise relatively few protons. Whereas, the product of 2.5Z generally approximates the value of ma of atoms that comprise relatively many protons. The product of ((2+2.5)/2)Z generally approximates the value of ma of atoms that comprise a moderate number of protons.
What function from the Z values produces a value that maximally approximates the ma that corresponds to Z?
Answer
The short answer is that you can find a power-law fit (1.61Z1.1) with low average error.
I'd never really thought about it much, but after downloading the IUPAC Atomic Weights, I decided to do some curve fitting.
Here's a linear fit between atomic number and atomic mass:
As you say, the fit isn't very good for small Z, but the overall fit isn't bad - the mean absolute error (MAE) is 2.821u, and taken as a whole, the data is surprisingly linear. (Well, surprising to me.)
So I thought of a quadratic fit, requiring the intercept to be 0,0 to ensure the best fit for small Z:
Looks better, right? Certainly the fit is much better for first and second row elements, but the MAE only reduces to 2.749u.
So I went up to a cubic fit, again requiring 0,0 for the intercepts:
Aha, now we're talking! We get the subtle nonlinearities, and the MAE is down to 1.36u.
Thanks to the comment by Nicolau below, I performed a power-law fit.
So that gives a power-law fit with MAE of 0.01u and a fairly easy-to remember function:
ma≈1.61Z1.1
No comments:
Post a Comment