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Suppose you’re given a two-level quantum system whose (time-independent) Hamiltonian H0admits just two Eigen states, Ψa (with energy Ea ), and Ψb(with energy Eb ). They are orthogonal, normalized, and non-degenerate (assume Ea is the smaller of the two energies). Now we turn on a perturbation H′, with the following matrix elements:

Ψa|H'|Ψa=Ψb|H'|Ψb=0;Ψa|H'|Ψb=Ψb|H'|Ψa (7.74).

where h is some specified constant.

(a) Find the exact Eigen values of the perturbed Hamiltonian.

(b) Estimate the energies of the perturbed system using second-order perturbation theory.

(c) Estimate the ground state energy of the perturbed system using the variation principle, with a trial function of the form

Ψ=(cosϕ)Ψa+(sinϕ)ψb (7.75).

where ϕ is an adjustable parameter. Note: Writing the linear combination in this way is just a neat way to guarantee that ψ is normalized.

(d) Compare your answers to (a), (b), and (c). Why is the variational principle so accurate, in this case?

Short Answer

Expert verified

(a)E±=12Ea+Eb±Ea-Eb2+4h2

(b)E-Ea-h2Eb-Ea;E+Eb+h2Eb-Ea

(c)Hmin=-12Ea+Eb±Eb-Ea2+4h2

(d) Using Taylor series (small h) to expand results in (a) we obtained results from

Step by step solution

01

(a) Finding the exact Eigen value

In order to find Eigen values of H, calculate:

detH-λ.l=0Ea-λEb-λ-h2=0λ2-λEa+Eb+EaEb-h2=0

λ=12Ea+Eb±Ea2+2EaEb+Eb2-4EaEb+4h2E±=12Ea+Eb±Ea-Eb2+4h2

02

Step 2:(b) Estimating the energies

Zero order: Ea0=Ea,Eb0=Eb

First order: Ea1=ψa|H'|ψa=0,Eb1=ψb|H'|ψb=0

Second order:

Ea2=ψb|H'|ψa2Ea-Eb=-h2Eb-Ea;Eb2=ψa|H'|ψb2Eb-Ea=h2Eb-EaE-Ea-h2Eb-Ea;E+Eb+h2Eb-Ea

03

 Step 3:(c) Estimating the ground state energy

Here estimating the ground state energy.

H=cosϕψa+sinϕψbH0+H'cosϕψa+sinϕψb=cos2ϕψa|H0|ψa+sin2ϕψb|H0|ψb+sinϕcosϕψb|H'|ψa+sinϕcosϕψa|H'|ψb=Eacos2+Ebsin2ϕ+2hsinϕcosϕ

So,

Hϕ=-Ea2cosϕsinϕ+Eb2sinϕcosϕ+2hcos2ϕ-sin2ϕ=Eb-Easin2ϕ+2hcos2ϕ=0tan2ϕ=-2hEb-Ea=-o˙whereo˙2hEb-Ea.sin2ϕ1-sin22ϕ=-o˙;sin22ϕ=o˙21-sin22ϕorsin22ϕ1+o˙2=o˙2;sin2ϕ=±o˙1+o˙2;cos22ϕ=1-sin22ϕ

=1-o˙21+o˙2=11+o˙2;cos2ϕ=+11+o˙2signdictatedbytan2ϕ=sin2ϕcos2ϕ=-o˙.cos2ϕ=121+cos2ϕ=121+11+o˙2;sin2ϕ=121-cos2ϕ=121±11+o˙2

Hmin=12Ea1+11+o˙2+12Eb1±11+o˙2±ho˙1+o˙2=12Ea+Eb±Eb+Ea+2ho˙1+o2˙

But

Eb-Ea+2ho˙1+o˙2=Eb-Ea+2h2hEb-Ea1+4h2Eb-Ea2=Eb-Ea2+4h2Eb-Ea2+4h2=Eb-Ea2+4h2SoHmin=12Ea+Eb±Eb-Ea2+4h2

04

 Step 4:(d) Comparing (a),(b) and (c)

We can obtain results from task (b) if we expand in Taylor series exact energies from task (a). we use limit where h is very small, which has to be if we want to use perturbation theory:

E±=12[Ea+Eb±Eb+Ea1+4h2Eb+EaE±12Ea+Eb±Eb+Ea1+2h2Eb+Ea2=12Ea+Eb±Eb+Ea±2h2Eb+Ea

so localid="1658396154675" E+Eb+h2Eb+Ea,E-Ea-h2Eb+Ea,

Confirming the perturbation theory results in (b). The variation principle (c) gets the ground state(E−) exactly right-not too surprising since the trial wave function Eq. 7.75 is almost the most general state (there could be a relative phase factor eiθ .

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Most popular questions from this chapter

(a) Use a trial wave function of the form

ψ(x)={Acos(πx/a),if(a/2<x<a/2)0otherwise

to obtain a bound on the ground state energy of the one-dimensional harmonic oscillator. What is the "best" value ofa? CompareHminwith the exact energy. Note: This trial function has a "kink" in it (a discontinuous derivative) at±a/2; do you need to take account of this, as I did in Example 7.3?

(b) Useψ(x)=Bsin(πx/a)on the interval(a,a)to obtain a bound on the first excited state. Compare the exact answer.

(a) Prove the following corollary to the variational principle: If ψψgs=0thenáHñEfe whereEfe is the energy of the first excited state. Comment: If we can find a trial function that is orthogonal to the exact ground state, we can get an upper bound on the first excited state. In general, it's difficult to be sure that is orthogonal toψgsi since (presumably) we don't know the latter. However, if the potentialV(x) is an even function of x, then the ground state is likewise even, and hence any odd trial function will automatically meet the condition for the corollary.

(b) Find the best bound on the first excited state of the one-dimensional harmonic oscillator using the trial functionψ(x)=Axe-bx2

Find the best bound on Egsfor the one-dimensional harmonic oscillator using a trial wave function of the form role="math" localid="1656044636654" ψ(x)=Ax2+b2.,where A is determined by normalization and b is an adjustable parameter.

The fundamental problem in harnessing nuclear fusion is getting the two particles (say, two deuterons) close enough together for the attractive (but short-range) nuclear force to overcome the Coulomb repulsion. The “bulldozer” method is to heat the particles up to fantastic temperatures and allow the random collisions to bring them together. A more exotic proposal is muon catalysis, in which we construct a “hydrogen molecule ion,” only with deuterons in place of protons, and a muon in place of the electron. Predict the equilibrium separation distance between the deuterons in such a structure, and explain why muons are superior to electrons for this purpose.

Quantum dots. Consider a particle constrained to move in two dimensions in the cross-shaped region.The “arms” of the cross continue out to infinity. The potential is zero within the cross, and infinite in the shaded areas outside. Surprisingly, this configuration admits a positive-energy bound state

(a) Show that the lowest energy that can propagate off to infinity is

Ethreshold=π2h28ma2

any solution with energy less than that has to be a bound state. Hint: Go way out one arm (say xa), and solve the Schrödinger equation by separation of variables; if the wave function propagates out to infinity, the dependence on x must take the formexp(ikxx)withkx>0

(b) Now use the variation principle to show that the ground state has energy less than Ethreshold. Use the following trial wave function (suggested by Jim Mc Tavish):

ψ(x,y)=A{cos(πx/2a)+cos(πy/2a)e-αxaandyacos(πx/2a)e-αy/axaandy>acos(πy/2a)e-αy/ax.aandya0elsewhere

Normalize it to determine A, and calculate the expectation value of H.
Answer:

<H>=h2ma2[π28-1-(α/4)1+(8/π2)+(1/2α)]

Now minimize with respect to α, and show that the result is less thanEthreshold. Hint: Take full advantage of the symmetry of the problem— you only need to integrate over 1/8 of the open region, since the other seven integrals will be the same. Note however that whereas the trial wave function is continuous, its derivatives are not—there are “roof-lines” at the joins, and you will need to exploit the technique of Example 8.3.

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