Exploring Spherical Harmonics and Hydrogen Wave Functions: A Class Activity, Assignments of Physics

Instructions for a class activity where students explore spherical harmonics and hydrogen wave functions using interactive web applications. Students are asked to analyze the shapes of spherical harmonic functions for different values of l and ml, and to relate these shapes to the angular momentum vectors and quantum states of electrons. The document also includes instructions for using two specific web applications and suggestions for exploring different quantum states.

Typology: Assignments

Pre 2010

Uploaded on 08/31/2009

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Hydrogen wave functions – class activity October 31.
Now we have talked for a while about the radial wave functions and are starting to think
about the spherical harmonics. Open a web browser and go to www.vis.uni-
stuttgart.de/~kraus/LiveGraphics3D/java_script/SphericalHarmonics.html. This applet
will allow you to look at the spherical harmonic functions for values of l and ml up to 5.
Before you start, click “enlarge” once or twice to make a larger picture, and increase the
resolution in both the angles to about 30 or 40. Also, under “Spherical polar plot of”
choose “absolute value (colored by complex phase)”. Now choose l = 1, and ml = 0 and
plot it. You will now see a 3D object. For each value of θ and φ, the absolute value of the
spherical harmonic function for those coordinates is represented by the distance from the
origin (so a large value, like right on the z-axis, is represented by a long distance from the
origin to the top of the object, and a small value (like zero along the xy-plane for which z
is zero) is represented by a short distance from the axis.
1) Look at the formula for Y10(θ,φ) – does that help you understand the plot of the
funtion? Try to in particular pay attention to the angles for which the Y10 function should
have its maximum, minimum, and zero. Can you guess what the two different colors
represent?
2) Do the same for Y1,1(θ,φ) and Y1,-1(θ,φ) – look at the formula and plot the function
and try to make sense of what you see. Explain why there is no difference in the plots
with ml = +1 and ml = -1.
3) Next let us try to understand why the electron angular distributions would look like
this for the l = 1, ml = 0 cases, and the l = 1, ml = ±1 cases. Start by sketching the
(classical) motion that would give rise to an angular momentum vector that points
straight upwards, along the positive z-direction. Which motion would give rise to an
angular momentum vector pointing in the positive x-direction?
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Hydrogen wave functions – class activity October 31.

Now we have talked for a while about the radial wave functions and are starting to think about the spherical harmonics. Open a web browser and go to www.vis.uni- stuttgart.de/~kraus/LiveGraphics3D/java_script/SphericalHarmonics.html. This applet will allow you to look at the spherical harmonic functions for values of l and ml up to 5. Before you start, click “enlarge” once or twice to make a larger picture, and increase the resolution in both the angles to about 30 or 40. Also, under “Spherical polar plot of” choose “absolute value (colored by complex phase)”. Now choose l = 1, and ml = 0 and plot it. You will now see a 3D object. For each value of θ and φ, the absolute value of the spherical harmonic function for those coordinates is represented by the distance from the origin (so a large value, like right on the z-axis, is represented by a long distance from the origin to the top of the object, and a small value (like zero along the xy-plane for which z is zero) is represented by a short distance from the axis.

  1. Look at the formula for Y 10 (θ,φ) – does that help you understand the plot of the funtion? Try to in particular pay attention to the angles for which the Y 10 function should have its maximum, minimum, and zero. Can you guess what the two different colors represent?
  2. Do the same for Y1,1(θ,φ) and Y1,-1(θ,φ) – look at the formula and plot the function and try to make sense of what you see. Explain why there is no difference in the plots with ml = +1 and ml = -1.
  3. Next let us try to understand why the electron angular distributions would look like this for the l = 1, ml = 0 cases, and the l = 1, ml = ±1 cases. Start by sketching the (classical) motion that would give rise to an angular momentum vector that points straight upwards, along the positive z-direction. Which motion would give rise to an angular momentum vector pointing in the positive x-direction?

Now remember the pictorial representation of space quantization we discussed in class Monday – that the angular momentum vector could only point in certain directions, depending on the ml quantum number. Which ml corresponds to an L-vector in the positive x-direction, and which ml corresponds to an L-vector which is (the most) in the positive z-direction? Now go back and look at the spherical harmonics and see if it all comes together.

  1. Explore the spherical harmonics for larger l and ml values. In particular (a) look at the functions where ml = l, as l increases. What is the general shape of these functions? And how do they change with increasing l? Does this make sense from looking at their formulas? (b) For a given l, what happens as you decrease ml from l to zero? What is the most general thing you can say about the ml = 0 functions? (think of the l = 1, ml =0 example you started out with).
  2. Now we are ready to look at the hydrogen wave functions of all three coordinates, r, θ, and φ. Open a new window in your browser and go to www.falstad.com/qmatom. In the controls on the right choose “Complex orbitals (phys)”, and click “stopped”. Choose the n = 1 state to look at first. This applet shows you the 3D probability density (the brightness of the light indicates the value of the probability density at any given point). To start with you are looking at an xz-plane – you can rotate your view by pulling on the coordinate system in the top right corner. Look at some s-states (l = 0) for various values of n. Do you understand what you see? The applet is showing you the product of the radial probability densities and the angular probability densities you have been looking at so far. On the next page I have included a figure of the a couple of radial probability densities. (Note that the program rescales the axes automatically when you choose a different wave function to look at).