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Berry’s phase and the anomalous velocity of Bloch wavepackets ∗ Y. D. Chong Department of Applied Physics, Yale University, New Haven, Connecticut 06520 (Dated: January 25, 2010) The semiclassical equations of motion for a Bloch electron include an anomalous velocity term analogous to a k-space “Lorentz force”, with the Berry connection playing the role of a vector potential. ByexaminingtheadiabaticevolutionofBlochstatesinamonotonically-increasingvector potential,IshowthattheanomalousvelocitycanbeexplainedasthedifferenceintheBerry’sphase acquired by adjacent Bloch states within a wavepacket. 0 1 PACSnumbers: 72.10.Bg,72.15.Gd,72.20.My 0 2 When inversion or time-reversal symmetry is broken, connection (the “Berry curvature”). The idea is simple: n a the semiclassicalmotionforaBlochelectronis knownto a small DC electric field can be represented by a con- J contain an additional non-vanishing term analogous to stant vector potential that increases monotonically with 5 the Lorentz force in momentum-space: time. Each Bloch state undergoes adiabatic evolution in 2 thisvectorpotential,andacquiresaBerry’sphase. Each 1 ] r˙ = ~∇kEk+k˙ ×(∇k×Ak). (1) Bk-lsopcahcecotmrapjeocnteonrty,oafnadwacaqvueipraecskaedtiuffnedreenrtgoBeesrray’dsiffpehraesnet. r e Here,kisthereducedwave-vector,E isthebandenergy, The resulting Berry’sphase differences, characterizedby h k ∇ denotes a k-space derivative, and A is defined by the Berry curvature, conspire to induce the anomalous t k k o term in the velocity of the wavepacketas a whole. at. A~k = 1i ddru∗k(r)∇kuk(r), (2) netFiocrfiseimldp(liwcihtoyseofpprreesseenncteatdiooens, Inowtilallitgenrotrheethfienamlarge-- m ZΩ sults). A Hamiltonian for a Bloch electron subjected to withtheintegraltakenovertheunitcellΩandu (r) de- - k an additional small electric field Exˆ is d noting the Bloch function. The “anomalous velocity”— on tinhaellsyecdoenrdivteedrmbyonKtahreprluigshtanhdanLdustitdinegoefr(11)in—wthaesiroreixg-- H′ =−2~m2 ∇2+V(r)−eEx, (3) c planation of the extraordinary Hall coefficients of fer- [ where V(r) is the lattice potential, which can break in- romagnetic materials, based on a careful examination 2 of wavepacket dynamics. Subsequently, Chang and Niu version symmetry. A gauge transformation φ → φ − v re-derived the anomalous velocity using an effective- (1/c)∂tΛandA→A+∇Λ,whereΛ=−Ecxt, yieldsthe 6 equivalent periodic time-dependent Hamiltonian Lagrangian technique, and pointed out that A~ is the 1 k 7 important quantity known as the Berry connection2. ~2 et 2 0 In its original context, the Berry connection describes H(t)= 2m −i∇+ ~E~ +V(r). (4) . the gauge structure of a quantum state as it undergoes (cid:20) (cid:21) 2 1 adiabatic evolution, following a trajectory ~λ(t) in some The quantumstates of the new Hamiltonianhave an ex- 9 parameterspaceofthesystemHamiltonianH(λ(t)). The tra phase factor of exp(−ieExt/~), which is the same for 0 line integral of the Berry curvature, taken over ~λ(t), all states and therefore irrelevant. v: yields “Berry’sphase”—anadditionalphase acquiredby As pointed out by Kittel6, H now has the form of a i the quantum state during the adiabatic process3. As reduced Hamiltonian: X first appreciated by Simon4, the Berry connection also et ar emergeswithinBlochsystems,inamannerthat appears H(t) = H(~q(t)), ~q(t)= ~ E~, (5) to be quite different: the reduced wave-vector k serves ~2 2 as the “parameter” for the reduced Hamiltonian H(k), H(k) ≡ −i∇+~k +V(r). (6) 2m and A~ describes the gauge structure of the Bloch func- k h i tions u (r) within the Brillouin zone. (In particular, the This allows us to describe the effects of the electric field k integral of A~ along the boundary of a two-dimensional in terms of adiabatic evolution. Similar considerations k Brillouin zone yields the TKNN number, which equals were used by Zak in a related one-dimensional model7. the index of the integer quantum Hall effect5.) The Bloch states are eigenstates of H(~k) with band I would like to present a derivation of the anoma- energies E(k) (suppressing the irrelevant band index): lous velocity that clarifies its relationship with adiabatic H(k)u (r)=E(k)u (r). (7) quantum evolution, the context in which the Berry con- k k nection first arose. One virtue of this derivation is that It is easily seen that it provides a simple geometrical explanation of why the anomalousvelocityinvolvesthek-spacecurloftheBerry H(k′) uk′+k(r)eikr =E(k′+k) uk′+k(r)eikr . (8) (cid:2) (cid:3) (cid:2) (cid:3) 2 and k. The k-space displacement is simply q(t). The r-space displacement is determined by the phase factors on the last line of (14), which should have the form (overall phase factor)×exp[i∆k·r(t)], FIG.1: k-spacelineintegralsgivingrisetotheBerry’sphases where the overall phase factor comes from the phase of in equation (16). the central wavepacketk (t) and the second term comes o from the phase difference between k(t) and k (t). o From these considerations, we see that the phase dif- Therefore, at each time t the Hamiltonian H(q(t)) pos- sesses a set of instantaneous eigenstates u (r)eikr. ferences between k and k0 which arise from the band q(t)+k energies yield the usual group velocity: (For t = 0, these are the usual Bloch states.) If the electric field E is weak, the change is adiabatic. d 1 t Suppose we have the initial state ∆k·~v = dt′[E(k(t′))−E(k (t′))] (15) g dt ~ 0 ψ(r,t=0)=uk(r)eikr. (9) (cid:26) 1Z0 (cid:27) = ∆k· ∇ E(k (t)) . (16) ~ k 0 According to Berry’s theorem3, the state at time t is (cid:20) (cid:21) i t I nowclaimthatthe Berry’sphasedifferences givethe ψ(t)=u eikr exp − dt′E(k(t′)) eiγk(t), (10) anomalous velocity: k(t) ~ (cid:20) Z0 (cid:21) d k(t) k0(t) where k(t)≡k+q(t). Berry’s phase, γk(t), is given by ∆k·~va = d~k′·A~k′ − d~k′′·A~k′′ . (17) dt (Zk(0) Zk0(0) ) γk(t) = i d~q′· ddr uq′+keikr ∗∇q′ uq′+keikr To prove this, observe that the line integrals are taken Z (cid:20)ZΩ (cid:21) k(t) (cid:0) (cid:1) (cid:0) (cid:1) overthetopandbottomsegmentsoftheparallelogramin = − d~k′·A~k′, (11) Fig.1. When∆kissufficientlysmall,integrals d~k′·A~k′ Zk(0) over the side segments become negligible; then the two R separateline integralscanbe replacedwith a single edge with the integral taken over the trajectory of k(t). integral,takenclockwisearoundtheboundaryΓ(t)ofthe Now consider a wavepacketcomposed of Bloch states, paralleogram: initially centered on the Bloch state with k =k : 0 ψ(r,0) = f(|k−k0|)uk(r)eikr (12) ∆k·~va ≈ d d~k′·A~k′ (18) dt Xk (IΓ(t) ) = eik0r f(|∆k|)uk(r)ei∆k·r, (13) d Xk = −dt(Za(t)da·(cid:16)∇k×A~k′(cid:17)). (19) where ∆k = k − k and f is some envelope function. 0 From (10) and (11), the wavepacketat time t is In time dt, the edge advances by k˙dt, and the additional area (grey region in Fig. 1) is (k˙ ×∆k)dt. Thus, ψ(r,t)=eik0r f(|∆k|)u (r) k(t) Xk ∆k·~va = ∇k×A~k0 · ∆k×k˙ (20) ×ei∆k·rexp −i tdt′E(k(t′)) eiγk(t). (14) = ∆(cid:16)k· k˙ ×∇(cid:17) ×(cid:16) A~ .(cid:17) (21) ~ k k0 (cid:20) Z0 (cid:21) (cid:16) (cid:17) Note that k(t)−k (t) = ∆k is time-independent. Com- This is precisely the anomalous velocity given in (1). 0 paring (14) to (13), we observe displacements in both r I am grateful to P. A. Lee for helpful discussions. ∗ Electronic address: [email protected] 4 B. Simon, Phys.Rev. Lett.51, 2167 (1983). 1 R.Karplusand J. M. Luttinger, Phys.Rev.Lett. 95, 1154 5 D. J. Thouless, M. Kohmoto, M. Nightingale, and M. den (1954). Nijs, Phys. Rev.Lett. 49, 405 (1982). 2 M.C.ChangandQ.Niu,Phys.Rev.Lett.75,1348(1995), 6 C. Kittel, Quantum Theory of Solids (Wiley, New York, Phys.Rev.B 53, 7010 (1996). 1963), p. 190. 3 M. V. Berry,Proc. R. Soc. A392, 45 (1984). 7 J. Zak, Phys.Rev.Lett. 62, 2747 (1989).

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