Solution

ID: past-exam-of-the-quantum-condensed-matter-course-of-the-university-of-cambridge/2015/paper-1/1/b/solution

Let the atomic spacing be and define the nearest-neighbour matrix elements , using the same translated orbital convention on every site. Then
For the opposite sigma and pi hopping signs in a p-orbital chain, consider first: neighbouring lobes above the chain have the same sign, so the in-phase Bloch sum is bonding. Thus and
For , the lobes facing one another have opposite signs for equal site coefficients. Bonding therefore needs alternating coefficients, giving and
End-on overlap is normally stronger than side-on overlap, so the band is wider, with bandwidths and . The curve orientations require a stated hopping-sign convention; a Hamiltonian written with an explicit minus sign in front of the hopping uses correspondingly opposite parameter signs.[ref]
Figure 1.
End-on and side-on p-orbital hopping give opposite tight-binding band orientations
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