Past exam of the physics A course of the University of Cambridge / 2021 / Paper 2 / Section C / C8 / b / Solution

Choose the Fourier series conventionFor a real potential energy, $V_{-1}=V_1^{\ast }$. The symbol $V(G_1)$ means the Fourier coefficient $V_1$, with units of energy, rather than the pointwise value of $V(x)$ at a position $G_1$.

Retain the two plane waves $|1⟩=L^{-1/2}{e}^{ikx}$ and $|2⟩=L^{-1/2}{e}^{i(k-G_1)x}$ in the nearly-free electron model. Their kinetic energies are ${ϵ}_1={\hslash }^2{k}^2/(2m)$ and ${ϵ}_2={\hslash }^2(k-G_1{)}^2/(2m)$. The matrix representation of a linear map for the Quantum Hamiltonian projected onto this two-dimensional basis isThus $\det (H-EI)=0$ givesSolving this quadratic equation yieldsChoosing the zero of potential energy so that its spatial average is $V_0=0$ reproduces the requested expression. If that average has not been removed, both energy bands are shifted by $V_0$; no band gap, group velocity or effective mass is changed by this constant shift.

The two kinetic energies coincide at $k=G_1/2$. Their coupling gives an avoided crossing with band gap $2|V_1|$. The result is exact within the projected two-wave Quantum Hamiltonian. It is an approximation to the full crystal problem, appropriate near this crossing for a weak periodic potential whose other Fourier coefficients do not cause strong mixing with remote plane waves. Small $|V_1|$ alone would not justify ignoring arbitrarily large other Fourier coefficients.