Yukawa Potential Homework: Sketch, Schrodinger Eq & Perturbation Theory

[Hart]

Homework Statement

The Yukawa potential is given by:

V_{\gamma}(r) = -\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r}

Where \gamma is a constant. This describes a screened Coulomb potential.

I. Sketch the radial dependence of this potential.

II. State the radial Schrödinger equation for this potential.

III. Assume that \gamma is a small parameter. Use first order perturbation theory to estimate the energy shift of the ground state of the hydrogen atom when the Coulomb potential is replaced by the Yukawa potential. Hint: The perturbation is:

\omega = V_{\gamma}-V_{0}.

Homework Equations

Within the question statement / answers.

The Attempt at a Solution

I don’t seem to be able to find much useful information about this potential which I can understand and/or use to try and answer this question.

I. Obviously I know that it’s hard to show what it looks like over these forums, but any description of what it looks like would be great.. I don’t know.

II. Help and advice needed!

III. Again, help and advice needed!

.. sorry I don't have really any input at the moment, but I really don't get what's going on here and havn't been able to find much info elsewhere.

 

[nickjer]

I) Just plot it in a graphing calculator or some software. It will look like:

\frac{-1}{r}e^{-r}

2) Just write out the Schrödinger equation in spherical coords using this potential for V(r)

3) Expand that perturbation to first order in lambda using a Taylor expansion. Then operate on this perturbation with the ground state:

E_0^{(1)} = <0|V_{\lambda}-V_0|0>

where |0> is the ground state of the hydrogen atom.

 

[Hart]

1. I don't have a graphical calculator and I havn't really managed to find any good free graphing software from online searches.. any useful links or advice?

2. So the Schrödinger equation in spherical polar coordinates:

E \psi \left(r, \theta, \phi \right) = \left[-\frac{\hbar^{2}}{2mr^{2}}\frac{\partial}{\partial r}\left(r^{2}\frac{\partial}{\partial r}\right) - \frac{\hbar^{2}}{2mr^{2}}\left(\frac{1}{sin \theta}\frac{\partial}{\partial \theta}\left(sin \theta \frac{\partial}{\partial \theta}\right) + \frac{1}{sin^{2}\theta}\frac{\partial^{2}}{\partial \phi^{2}}\right) + V(r)\right] \psi \left( r, \theta, \phi \right)

Hence with input of the potential defined:

E \psi \left(r, \theta, \phi \right) = \left[-\frac{\hbar^{2}}{2mr^{2}}\frac{\partial}{\partial r}\left(r^{2}\frac{\partial}{\partial r}\right) - \frac{\hbar^{2}}{2mr^{2}}\left(\frac{1}{sin \theta}\frac{\partial}{\partial \theta}\left(sin \theta \frac{\partial}{\partial \theta}\right) + \frac{1}{sin^{2}\theta}\frac{\partial^{2}}{\partial \phi^{2}}\right) + <br /> -\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r}\right] \psi \left( r, \theta, \phi \right)

3. I'm not sure how to do the Taylor expansion / perturbation thing :|

 

[Hart]

.. still can't figure out how to do part 3 of this question

This is as far as I've got:

E_{n}^{1} = E_{0}&#039; - E_{0} \approx \left&lt; \psi_{n}^{0}|\omega|\psi_{n}^{0}\right&gt;

so..

E_{n}^{1} = E_{0}&#039; - E_{0} \approx \left&lt; \psi_{n}^{0}|V_{\gamma}-V_{0}|\psi_{n}^{0}\right&gt;

.. and then I need to do some sort of Taylor expansion thing with the perturbation?!

Really don't get this

 

[nickjer]

What is the Taylor Expansion for an exponential?

 

[nickjer]

Also when they ask for the radial Schrödinger Eqn, I think they only want it in terms of 'r' and not theta and phi. You can separate out theta and phi using spherical harmonics.

 

[gabbagabbahey]

1. I don't have a graphical calculator and I haven't really managed to find any good free graphing software from online searches.. any useful links or advice?

At large r, e^{-r} falls off much faster than any polynomial of r, so you would expect it to look a lot like an inverted (because of the negative sign in front) decaying exponential there.

For small r, e^{-r}\approx 1-r so you would expect it to (again inverted) decay like 1/r from -\infty there.

In between the two extremes, you would expect it to decay slightly faster than an exponential, from a large negative value towards zero.

As for graphing software, gnuplot should be more than enough. I suggest you do three plots and superimpose them. Plot -\frac{1}{r}, -e^{-r} and -\frac{1}{r}e^{-r} together so you can compare their behavior at large and small r. It is also worth noting that \frac{1}{r}e^{-r}=1 at r\approx 0.567, so you may want to adjust the range of at least one of your graphs to examine the behavior near this point.

 

[Hart]

Taylor Expansion for an Exponential:

Isn't it this..

e^{x} = \sum_{n=0}^{\infty}\frac{x^{n}}{n!} = 1 + x + \frac{x^{2}}{2!} + \frac{x^{3}}{3!}+ ...

??!

If so, presumably then have to put the function:

\frac{-1}{r}e^{-r}

into it? where x = r?

Radial Schrödinger Equation:

.. oh, so you think it should be this instead:

ER = -\frac{\hbar^{2}}{2m_{e}}\frac{1}{r^{2}}\frac{d}{dr}\left(r^{2}\frac{dR}{dr}\right) + \left[V(r) + \frac{l(l+1)\hbar}^{2}{2m_{e}r^{2}}\right]R

then input given potential:

V_{\gamma}(r) = -\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r}

hence:

ER = -\frac{\hbar^{2}}{2m_{e}}\frac{1}{r^{2}}\frac{d}{dr}\left(r^{2}\frac{dR}{dr}\right) + \left[-\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r} + \frac{l(l+1)\hbar^{2}}{2m_{e}r^{2}}\right]R

?!


Yukawa Plot:

I plotted the three functions as suggested, and using the software suggested, this is a plot of them:

(nb1: apologies, can't figure out how to make the images smaller.)
(nb2: had to use x as variable not r, it wouldn't let me plot it otherwise)

So the Yukawa Potential should look like this:

.. yes?

 

[nickjer]

I) You don't need to plot negative 'r' since the radius is from 0 to infinity.

III) Actually you can solve it analytically without the need of an expansion to first order in \lambda

Try solving:
&lt;\psi_0|-\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r}|\psi_0&gt;

Using the hyrdrogen atom's ground state wavefunction, which should just be an exponential. Just be sure to integrate it in spherical coords.

That energy should be very similar to the ground state energy but with an extra \lambda term.

To check your answer. Let \lambda go to 0, and see if it matches the ground state energy when using the Coulomb potential.

 

[Hart]

1. OK so on that second graph, which will be the one I actually use and sketch to represent the Yukawa potential, there only needs to be the right hand side of it yes? i.e. only need the line going from y = -\infty to x = \infty?

2. Could you give a bit more guidance on how to do that? Just to get me started.

 

[nickjer]

&lt;\psi|V(r)|\psi&gt; = \int \int \int \psi^{\dagger}(r,\theta,\phi) V(r) \psi(r,\theta,\phi) r^2 sin(\theta) dr d\theta d\phi

Hint: The ground state wave function for your problem has no angular dependence. So the angular integrals will factor out and you get 4\pi from them:

&lt;\psi|V(r)|\psi&gt; = 4\pi \int \int \int \psi^{\dagger}(r) V(r) \psi(r) r^2 dr

 

[Hart]

.. so in that expression:

V(r) = \frac{-1}{r}e^{-r}

and

\psi(r)^{+} = \psi(r) = \frac{1}{\sqrt{\pi a^{3}}} e^{\left(\frac{-r}{a}\right)}

??

Then just need to input these - hence multiply them together? and then obviously integrate.

 

[nickjer]

Your V(r) has more terms in it than just that.

 

[Hart]

.. how?/why? .. the potential is given as:

V_{\gamma}(r) = -\frac{q^{2}}{4\pi \epsilon_{0}r}e^{-\gamma r}

but I thought that could take the factor out just to leave the exponential to put within the integrals?

 

[nickjer]

You need to solve the integral with the \gamma still in the potential. You can pull the other terms out front, but they will still be included in the final energy.

 

[Hart]

.. ok, so it should be this then:

V(r) = \frac{-1}{r}e^{-\gamma r}

as can take this bit outside the integral calculation:

\frac{q^{2}}{4\pi \epsilon_{0}}

do I just treat \gamma as a constant?

and also

\psi(r)^{+} = \psi(r) = \frac{1}{\sqrt{\pi a^{3}}} e^{\left(\frac{-r}{a}\right)}

??

 

[nickjer]

Yes, \gamma is a constant.

Also, that looks like the ground state of the hydrogen atom. So you are good there.

 

[Hart]

Right so using these:

V(r) = \frac{-1}{r}e^{-\gamma r} and \psi(r)^{+} = \psi(r) = \frac{1}{\sqrt{\pi a^{3}}} e^{\left(\frac{-r}{a}\right)}

I've got to that:

\psi^{\dagger}(r) V(r) \psi(r) = -\left(\frac{1}{\pi r a^{3}}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}

Therefore:

\int \psi^{\dagger}(r) V(r) \psi(r) r^2 dr = \int -\left(\frac{r}{\pi a^{3}}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}dr = -\left(\frac{1}{\pi a^{3}}\right)\int r e^{-\left(\frac{2}{a}+\gamma\right)r}dr

So:

\int r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = \left[-\left(\frac{r}{\frac{2}{a}+\gamma}\right)e^{-\left(\frac{2}{a}+r\right)r}\left] + \left[e^{-\left(\frac{2}{a}+r\right)}\right]

Hence:

\int \psi^{\dagger}(r) V(r) \psi(r) r^2 dr = -\left(\frac{1}{\pi a^{3}}\right)\int r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = -\left(\frac{1}{\pi a^{3}}\right)<br /> <br /> <br /> \left(1- \left(\frac{r}{\frac{2}{a}+\gamma}\right)\right)e^{-\left(\frac{2}{a}+r\right)r}

.. hopefully this is going along the right lines?! :shy:


.. if so, I then have to integrate twice more?

 

[nickjer]

You made a mistake in the 4th line. You might want to double check your 2nd term after the equal sign in that integration.

Also, not sure what you mean by integrate twice more. And where are the limits on your integral. The integral should be taken from 0 to infinity.

 

[Hart]

Ah, so it should be..

\int_{0}^{\infty} r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = \left[-\left(\frac{r}{\frac{2}{a}+\gamma}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}\left] + \left[e^{-\left(\frac{2}{a}+\gamma\right)r}\right] = \left[\left(1-\left(\frac{r}{\frac{2}{a}+\gamma}\right)\right)e^{-\left(\frac{2}{a}+\gamma\right)r}\right]^{\infty}_{0} = -1

..since e^{-\infty} = 0

??

and I meant, do I need to integrate this again as your expression had \int\int\int

 

[nickjer]

Your 2nd term after the first equal sign is still incorrect. You might want to double check your math.

Yes, it was a volume integral, but since there were no angular components in the potential or wavefunction. So I already integrated over theta and phi, and I got 4*Pi.

 

[Hart]

I don't see how?

I was using product rule, so..

\int_{0}^{\infty} r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = U.V

Therefore:

U.dV = \left[-\left(\frac{r}{\frac{2}{a}+\gamma}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}\left]

And:

V.dU = (1).e^{-\left(\frac{2}{a}+\gamma\right)r} = e^{-\left(\frac{2}{a}+\gamma\right)r}

.. I can't see where the mistake is (sorry!).

Right, thanks for clarifying that, so whatever this integral equals then multiplied by 4\pi is the answer?

 

[nickjer]

You have:

\int r e^{-\alpha r}dr

Use,
r = u
e^{-\alpha r} dr = dv

That gives,
dr = du
\frac{-1}{\alpha} e^{-\alpha r} = v

Use,
\int u dv = uv - \int v du
\int r e^{-\alpha r}dr = \frac{-r}{\alpha} e^{-\alpha r}+\int \frac{1}{\alpha} e^{-\alpha r}dr<br /> = \frac{-r}{\alpha} e^{-\alpha r}-\frac{1}{\alpha^2}e^{-\alpha r}

I left out the bounds for simplicity, but you should include them. I also used alpha to make my work easier.

 

[Hart]

Oh right OK I see, so it should be this then..

\int_{0}^{\infty} r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = \left(\left(-\frac{r}{\alpha}-\frac{1}{\alpha^{2}}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}\right)\right|^{\infty}_{0}

??

And then inputting the limits:

\implies = \left(\frac{r}{a}-\frac{1}{\alpha^{2}}\right)

??

Therefore:

\implies = 4 \pi \left(\frac{r}{a}-\frac{1}{\alpha^{2}}\right)

??

 

[nickjer]

You seem to still have an 'r' leftover. You need to set the limits for all the 'r's in the equation.

 

[Hart]

.. of course! what a silly mistake there!

so..

\int_{0}^{\infty} r e^{-\left(\frac{2}{a}+\gamma\right)r}dr = \left(\left(-\frac{r}{\alpha}-\frac{1}{\alpha^{2}}\right)e^{-\left(\frac{2}{a}+\gamma\right)r}\right)\right|^{\infty}_{0}

??

And then inputting the limits:

\implies = \left(0-\frac{1}{\alpha^{2}}\right)

??

Therefore:

\implies = \left(-\frac{4 \pi }{\alpha^{2}}\right)

.. better?

 

[nickjer]

Yes, now put back in all the constants. And it should look very similar to the ground state energy of a hydrogen atom using the coulomb potential.

 

[Hart]

Um, right so this:

\frac{q^{2}}{4\pi \epsilon_{0}}

Hence:

&lt;\psi|V_{\gamma}(r)|\psi&gt; = -\left(\frac{q^{2}}{\alpha^{2}\epsilon_{0}}\right)

??

 

[nickjer]

There are more constants out front than just that. You should write out the whole equation from the beginning. And keep track of all the constants.

Also, you need to substitute back in what alpha is. You can't have alpha there, since I made it up to make the work simpler.

 

[Hart]

I've got that:

\alpha = \frac{2}{a}+\gamma

Therefore:

-\left(\frac{4 \pi }{\alpha^{2}}\right) = -\left(\frac{4 \pi }{\left(\frac{2}{a}+\gamma\right)^{2}}\right)

.. but then don't see where to go from that.