Consider the potential barrier shown below. In classical mechanics, an incoming particle with energy \(E < V_{\mathrm{max}}\) is reflected with probability \(1\) and cannot reach \(x = + \infty\). In quantum mechanics, there can be a non-zero probability for the particle to be transmitted through to \(x =+\infty\). This phenomenon is known as “quantum tunnelling”.
Let us revisit the finite step potential, \[V(x) = \begin{cases} 0 & \quad x < 0 \\ V_0 & \quad x \geq 0 \end{cases} \, ,\] where we assume \(V_0 >0\). We consider incoming particles of definite energy \(E>0\). There are two regimes to consider:
“Scattering” : \(E>V_0\).
“Tunnelling” : \(0<E<V_0\).
The scattering regime \(E>V_0\) corresponds to the case where classically an incoming particle would be automatically transmitted. We covered this in the last lecture so we summarise the results here.
The Hamiltonian eigenfunctions take the form \[\phi(x) = \begin{cases} e^{ikx} + r e^{-ikx} & \quad x < 0 \\ t e^{ik'x} & \quad x > 0 \end{cases} \, ,\] where \[k = \sqrt{2mE/\hbar^2} \qquad k' = \sqrt{2m(E-V_0)/\hbar^2} \, .\] The coefficients \(r\), \(t\) are found by requiring that the wave function and its derivative are continuous at \(x = 0\), with the result \[r = \frac{k-k'}{k+k'} \qquad t = \frac{2k}{k+k'} \, .\]
The wave functions are not square-normalizable and to extract physical information we instead compute ratios of probability currents. The probability current is \[J(x) = \begin{cases} J_I - J_R& \quad x < 0 \\ J_T & \quad x >0 \end{cases}\] where \[J_I = \frac{\hbar k}{m} \qquad J_R = \frac{\hbar k}{m} |r|^2 \qquad J_T = \frac{\hbar k'}{m} |t|^2 \, .\] The reflection and transmission probabilities are then \[\begin{aligned} R & = \frac{J_R}{J_I} = |r|^2 = \left( \frac{k-k'}{k+k'} \right)^2 \\ \nonumber T & = \frac{J_T}{J_I} = \frac{k'}{k}|t|^2 = \frac{4kk'}{(k+k')^2} \, . \end{aligned}\] As a consistency check, we have \(R + T = 1\). The reflection and transmission coefficients are sketched below for \(V_0 < E < \infty\).
Now consider \(0<E<V_0\). In the region \(x>0\), where \(E-V_0\) has changed sign, the Hamiltonian eigenfunction now has an exponential decay \[\phi(x) = \begin{cases} e^{ikx} + r e^{-ikx} & \quad x < 0 \\ t e^{-\kappa x} & \quad x > 0 \end{cases} \, ,\] where now \(\kappa = \sqrt{2m(V_0-E)/\hbar^2}\). We discard the other potential solution \(e^{\kappa x}\) which would diverge at \(x \to +\infty\).
Notice that the above wave function can be obtained from the scattering problem by replacing \(k' \to i \kappa\). This means we can immediately write down the solution for the coefficients \(r\), \(t\), \[r = \frac{k-i\kappa }{k+i\kappa} \qquad t = \frac{2k}{k+i\kappa} \, .\] This dramatically changes the computation of the probability currents, which involve both the wave function and its conjugate. In particular, the reflected probability current is now equal to the incoming probability current, \[J_R = \frac{\hbar k }{m}|r|^2 = \frac{\hbar k }{m}\left| \frac{k-i\kappa }{k+i\kappa} \right|^2 = \frac{\hbar k}{m} = J_I \, .\] Meanwhile, the transmitted probability current now vanishes, \[\begin{aligned} J_T & = \frac{\hbar}{2mi}(\overline{\phi(x)}\partial_x \phi(x) - \phi(x)\partial_x \overline{\phi(x)}) \qquad x>0 \\ \nonumber & =\frac{\hbar}{2mi}(e^{-\kappa x}\partial_x e^{-\kappa x} - e^{-\kappa x}\partial e^{-\kappa x}) \\ & = 0 \, , \end{aligned}\] because \(e^{-\kappa x}\) is a real function of \(x\).
In summary, we conclude that \[R = 1 \qquad T = 0\] in the tunnelling regime \(0<E<V_0\). Note the following points:
This is consistent with the limit \(E \to V^+_0\) in the scattering regime \(E>V_0\).
It coincides with the classical expectation that the particle is always reflected when \(0<E<V_0\).
Despite the fact that \(T = 0\), the probability density is non-zero in the region \(x>0\) so there is therefore a non-vanishing probability to find the particle with \(x>0\). The probability density is sketched below. In contrast, the particle is forbidden from the region \(x>0\) in classical mechanics
This has important consequences if we were to add a step down to \(V(x) = 0\) at some finite distance \(x = L\). The wave function would then be expected to decay exponentially for \(0<x<L\), but then become trigonometric again for \(x>L\) and there is a possibility for the particle to escape to \(x \to + \infty\). This is known as “quantum tunnelling". We explore this in more detail now.
Let us now consider the finite barrier potential \[V(x) = \begin{cases} 0 & \quad x < 0 \\ V_0 & \quad 0 \leq x \leq L \\ 0 & \quad x>L \end{cases} \, .\]
In this case, we will see that there is a non-zero probability to find the particle to the right of the barrier even when \(E<V_0\).
The scattering regime corresponds again to \(E>V_0\). The Hamiltonian eigenfunctions are trigonometric in all regions, \[\phi(x) = \begin{cases} e^{ikx} + r e^{-ikx} & \quad x < 0 \\ A e^{ik' x} + B e^{-ik' x} & \quad 0<x<L \\ t e^{ i k x} & \quad x > L \end{cases} \, ,\] where the wavenumbers \(k\), \(k'\) are defined as above.
Since the potential remains finite at \(x = 0\) and \(x = L\), we need to impose that the wave function and its derivative are continuous there. This gives the constraints \[\begin{aligned} 1+r & = A+B \\ k(1-r) &= k'(A-B) \end{aligned}\] from \(x=0\) and \[\begin{aligned} Ae^{i k' L} + Be^{- i k'L} & = t e^{ikL} \\ k' (Ae^{ i k' L} - Be^{- ik' L}) & = k t e^{ikL} \, . \end{aligned}\] from \(x=L\). We have four linear equations for four variables \(r\), \(t\), \(A\), \(B\). The solution is found by elementary but tedious linear algebra that I will not reproduce here. The important output is the reflection / transmission probabilities \[\begin{aligned} R & = |r|^2 = \frac{(k^2-k'^2)^2 \sin^2(k'L)}{\left(k^2+k'^2\right)^2\sin^2(k'L) +4 k^2 k'^2 \cos^2(k'L)}\\ T & = |t|^2 = 1-R\, . \end{aligned}\] The important features are summarized below.
The limit \(E\to \infty\) corresponds to \(k,k' \to \infty\) with \(k/k' \to 1\). We find \(R \to 0\), \(T\to1\) reproducing the classical expectation for \(E>V_0\). The potential barrier is negligible compared to the energy and the particle is transmitted with probability \(1\).
The limit \(E \to V_0^+\) corresponds to \(k' \to0^+\), with \[R \to \frac{\gamma}{1+\gamma} \qquad T \to \frac{1}{1+\gamma}\] where \(\gamma = mL^2V_0 / 2\hbar^2\) is a dimensionless parameter.
The function has trigonometric dependence on \(k'\). In particular, the transmission probability becomes \(1\) whenever \(k'L = n\pi\) or equivalently \[E = V_0 + \frac{\hbar^2}{2m}\left(\frac{n\pi}{L} \right)^2\, .\] These “transmission resonances" correspond to a standing wave in \(0<x<L\). If we remember that the wavelength is \(\lambda = 2\pi / k'\), the condition becomes \(2L = n\lambda\) so the distance from \(x=0\) to \(x=L\) and back is an integer number of wavelengths. Intuitively, there is constructive interference between incident wave at \(x = 0\) and the standing wave in the region \(0<x<L\).
The tunnelling regime is \(0<E<V_0\). The Hamiltonian eigenfunctions are now \[\phi(x) = \begin{cases} e^{ikx} + r e^{-ikx} & \quad x < 0 \\ A e^{\kappa x} + B e^{-\kappa x} & \quad 0<x<L \\ t e^{ i k x} & \quad x > L \end{cases} \, ,\] where \(k\) and \(\kappa\) are defined as above.
As before, the coefficients \(r\), \(t\) are found by replacing \(k' \to i\kappa\) in the scattering regime. This modifies the reflection and transmission coefficients to \[\begin{aligned} R & = \frac{\left(k^2+\kappa ^2\right)^2 \sinh^2(\kappa L)}{\left(k^2-\kappa ^2\right)^2\sinh^2(\kappa L) +4 \kappa ^2 k^2 \cosh^2(\kappa L)} \\ T & = 1-R \, . \end{aligned}\] Note that there is a non-vanishing probability for the particle to be transmitted through the potential barrier and reach \(x = +\infty\), which is forbidden in classically. This is known as “quantum tunnelling".
The limit \(E \to 0\) corresponds to \(k \to 0\) with \(\kappa\) fixed. We find \(R\to 1\), \(T \to 0\) reproducing the classical expectation for \(E<V_0\).
The limit \(E \to V^-_0\) in the tunnelling regime coincides with the limit \(E \to V_0^+\) in the scattering regime.
Note the exponential rather than trigonometric dependence on \(\kappa\) in \(0<x<L\). In particular, there are no “resonances" like in the scattering regime.
Finally, we can combine the results in the scattering and tunnelling regimes to sketch the reflection / transmission probabilities across the entire range \(0<E<\infty\).
Consider the same problem but with \(E<V_0\).
How do the hamiltonian eigenfunctions change in the region \(x>0\)?
Explain why the probability current \(J\) vanishes for \(x>0\).
Show that \(R = 1\) and \(T=0\).
Sketch the probability density in the region \(x>0\).
(This problem is similar to problem 9 of the May 2019 exam and provided here to illustrate the method required to solve it. This problem was not part of the 2020-2021 module). Consider the finite potential well \[V(x) =\begin{cases} V_0 & \quad x \leq 0 \\ 0 & \quad 0<x<L \\ V_0 & \quad x \geq L \end{cases} \, .\]
Consider the following ansatz for “bound state" wavefunctions, \[\phi(x) = \begin{cases} A e^{\kappa x} & \quad x < 0 \\ B \sin{kx}+C \cos(kx) & \quad 0<x<L \\ D e^{-\kappa x} & \quad x> L \, . \end{cases}\]
Find constants \(\kappa\), \(k\) in terms of \(E\), \(V_0\) such that this is a Hamiltonian eigenfunction with energy \(0<E<V_0\).
Explain why there are no terms in the ansatz proportional to \(e^{-\kappa x}\) for \(x<0\) and \(e^{\kappa x}\) for \(x>L\).
What boundary conditions do the wavefunction obey at \(x = 0\) and \(x = L\)?
Impose the boundary conditions and eliminate \(A\), \(B\), \(C\), \(D\) to obtain the “quantisation condition" \[\frac{\kappa}{k} = \frac{\tan kL - \frac{\kappa}{k}}{1+\frac{\kappa}{k}\tan kL} \, .\]
Illustrate solutions of the quantisation condition graphically and show that
There is at least one solution independent of \(L\) and \(V_0\).
Show that you reproduce the spectrum of the infinite potential well in the limit \(V_0 \to \infty\).
Solution ▶
The Hamiltonian operator for \(x<0\) and \(x>0\) is \[\hat H = - \frac{\hbar^2}{2m} \partial_x^2 + V_0\] so the ansatz is a Hamiltonian eigenfunction with energy \(0<E<V_0\) provided \(\kappa = \sqrt{2m(V_0-E)/\hbar^2}\). The Hamiltonian operator for \(0<x<L\) is \[\hat H = - \frac{\hbar^2}{2m} \partial_x^2\] and the ansatz is a Hamiltonian eigenfunction with energy \(0<E<V_0\) provided \(k = \sqrt{2mE/\hbar^2}\).
These solutions diverge as \(x \to
-\infty\) and \(x \to \infty\)
respectively and are therefore not square-normalisable.
Since the potential remains finite both the wavefunction
\(\phi(x)\) and its derivative \(\phi'(x)\) are continuous at \(x = 0\) and \(x =
L\).
Although not asked for in the question, we can show this as follows.
First, continuity of \(\phi(x)\) is
required for a probabilistic interpretation. Second, consider the
equation obeyed by a Hamiltonian eigenfunction \[\phi''(x)
=\frac{2m}{\hbar^2}(V(x)-E)\phi(x) \, .\] We now integrate this
over a small interval \(-\epsilon < x<
\epsilon\) around the discontinuity in the potential at \(x = 0\) to find \[\phi'(x)|_\epsilon -
\phi'(x)|_{-\epsilon} = \frac{2m}{\hbar^2}\int^\epsilon_{-\epsilon}
(V(x)-E)\phi(x)dx \, ,\] where we assume \(\phi'(x)\) is continuous away from the
discontinuity. Provided \(V(x)\)
remains finite in \(-\epsilon < x<
\epsilon\), the integral on right vanishes in the limit \(\epsilon \to0\). We conclude that \(\psi'(x)\) also remains continuous
across \(x = 0\). The argument is
identical at \(x = L\).
We now impose the boundary conditions at \(x = 0\) and \(x=L\). First, from the requirement that the wavefunction and its derivative are continuous across \(x=0\), we have \[A = C \qquad \kappa A = kB \, .\] We can immediately eliminate \(A\), leaving \(\kappa C = k B\). Second, from the requirement that the wavefunction and its derivative are continuous across \(x=0\), we have \[\begin{aligned} A'e^{-\kappa L} & = B \sin kL +C \cos kL \\ & = C \left( \frac{\kappa}{k} \sin kL + \cos kL \right) \\ -\kappa A'e^{-\kappa L} & = k( B \cos kL - C \sin kL ) \\ & = \kappa C \left( \cos kL - \frac{k}{\kappa} \sin kL \right) \end{aligned}\] where we have eliminated \(B\) using \(\kappa C = k B\). Dividing these equations, we can eliminate the remaining constants \(A'\) and \(C\) to find \[\begin{aligned} \frac{\kappa}{k} & = \frac{\sin kL - \frac{\kappa}{k} \cos kL}{\cos kL+\frac{\kappa}{k}\sin kL} \\ & = \frac{\tan kL - \frac{\kappa}{k} }{1+\frac{\kappa}{k}\tan kL} \, . \end{aligned}\]
We first rearrange to find a quadratic equation for the ratio \(\kappa / k\), \[\tan kL \, \left(\frac{\kappa}{k}\right)^2 + 2 \left( \frac{\kappa}{k} \right) - \tan kL =0 \, .\] whose solution is \[\frac{\kappa}{k} = \frac{1}{\tan kL} \left( -1\pm \sqrt{1+\tan^2kL}\right) = \begin{cases} +\tan\left( \frac{kL}{2}\right) \\ -\cot\left( \frac{kL}{2}\right) \end{cases}\] Since \(\kappa\), \(k\) can be expressed in terms of \(E\), this is a constraint or “quantization condition" on the possible eigenvalues \(E\). It is impossible to solve analytically. However, we can understand the solutions graphically. For this purpose, it is convenient to introduce the dimensionless variables \[z = \frac{L}{2}\sqrt{\frac{2mE}{\hbar^2}} \qquad z_0 = \frac{L}{2}\sqrt{\frac{2mV_0}{\hbar^2}} \, .\] The quantization condition then becomes \[\sqrt{z_0^2/z^2-1} = \begin{cases} +\tan z \\ -\cot z \end{cases} \, .\] We can now understand the solutions by plotting both sides of this equation on the same graph and looking for their intersection points.
There is a discrete number of solutions, which increases with the dimensionless parameter \(z_0\). It is clear graphically that there is always at least one intersection point for \(0<z_0<\infty\).
The limit \(V_0 \to \infty\) corresponds to \(z_0 \to \infty\). In this limit, there are an infinite number of intersection points that move closer to the asymptotes \(z = \frac{n\pi}{2}\) for \(n \in \mathbb{Z}_{>0}\). From the definition of \(z\), the intersection points in this limit correspond to energies \[E = \frac{\hbar^2}{2m}\left(\frac{n\pi}{L}\right)^2 \, ,\] which are those of an infinite square well.