Validity of spin wave theory for the quantum Heisenberg model

Transcription

1 Validity of spin wave theory for the quantum Heisenberg model Michele Correggi, Alessandro Giuliani, and Robert Seiringer Dipartimento di Matematica e Fisica, Università di Roma Tre, L.go S. L. Murialdo, 0046 Roma, Italy Institute of Science and Technology Austria (IST Austria), Am Campus, 3400 Klosterneuburg, Austria Spin wave theory is a key ingredient in our comprehension of quantum spin systems, and is used successfully for understanding a wide range of magnetic phenomena, including magnon condensation and stability of patterns in dipolar systems. Nevertheless, several decades of research failed to establish the validity of spin wave theory rigorously, even for the simplest models of quantum spins. A rigorous justification of the method for the three-dimensional quantum Heisenberg ferromagnet at low temperatures is presented here. We derive sharp bounds on its free energy by combining a bosonic formulation of the model introduced by Holstein and Primakoff with probabilistic estimates and operator inequalities. PACS numbers: d, 75.0.Jm, Ds The quantum Heisenberg ferromagnet (QHF) is one of the simplest models used to describe the phenomenon of spontaneous breaking of a continuous symmetry. The understanding of its low-temperature properties is mostly based on spin-wave theory, which predicts a phase transition in three or more dimensions, and the T 3/ Bloch law for the magnetization [], whose experimental verification dates back to the 960s []. More recently, spinwave theory was successfully used to investigate Bose- Einstein condensates of quantum magnets [3, 4], such as ferromagnetic nanostructures [5 7] and magnetic insulators [8, 9], as well as the stability of patterns in dipolar thin films [0]. Despite its simplicity and its reliable predictions, a rigorous control of the spin-wave expansion remains to date a challenge. In the case of an underlying abelian symmetry, a number of rigorous results are available, based on reflection positivity [ 3], or cluster expansion combined with a vortex loop representation [4, 5]. The non-abelian case is trickier, and the few results available are mostly based on reflection positivity: see [3] for the classical Heisenberg and [] for the quantum Heisenberg anti-ferromagnet. In this letter, we present the key ingredients in a rigorous proof of the validity of the spin wave approximation at the level of the first non-trivial contribution to the free energy of the QHF in three dimensions at low temperatures. It is the first rigorous confirmation of the predictions of Bloch and Holstein-Primakoff. It comes more than 80 years after the original formulation of spinwave theory, and after more than 40 years of efforts of the mathematical physics community. While our method is not capable yet to control the spontaneous magnetization, it introduces new ideas in the field by deriving two novel rigorous inequalities, on the low-energy spectrum of the quantum spin model, as well as on the two-point function. These estimates allows us to rigorously reduce the many-body problem to a two-body one, which can be studied by probabilistic techniques. In comparison with methods based on reflection positivity, our method is robust: we do not expect that the results depend crucially on the underlying lattice structure, or on the nearest neighbor nature of the interaction. Still, in order to make our ideas as transparent as possible, we stick here to the simplest version of the model: we consider the Hamiltonian H Λ = ( S ) S x S y, () x,y Λ where Λ Z 3 is a cube, the sum is over all (unordered) nearest neighbor pairs x, y in Λ, and S x is a spin S operator with components S x = (S x, S x, S 3 x). The constant S is chosen to normalize the ground state energy of H Λ to zero. We denote the specific free energy in Λ by f(s,, Λ) = Λ ln Tr e HΛ, and by f(s, ) its value in the thermodynamic limit. Main result: For any S /, we have f(s, ) ( ln e Sε(p)) dp (π) 3 () to leading order in as, where ε(p) = 3 i= ( cos p i ). The right side of () is the free energy of a noninteracting lattice Bose gas with nearest neighbor hopping of amplitude S, and is predicted by spin wave theory. Asymptotically, it equals C 0 S 3/ 5/, with C 0 = The proof is based on rigorous upper and lower bounds. Until now, at finite S not even a sharp upper bound was known. Two non-optimal upper bounds were derived in [6, 7]. Sharp upper and lower bounds in a suitable large-s limit were derived in [8]. An important consequence of our proof is an instance of quasi long-range order: with a translation invariant Gibbs state at inverse temperature, S S x S y 7 8 x y e(s, ), (3)

2 where e(s, ) = (f(s, )) is the energy per site. Our main result says that e(s, ) 3 C 0S 3/ 5/ for large. Therefore, Eq. (3) implies that order persists up to length scales of the order 5/4, i.e., S x S y is bounded away from zero as long as x y (const.) 5/4. Spin wave theory predicts equality in (3) without the factor 7 8, asymptotically for x y. Of course, one expects infinite range order at low temperatures, but in absence of a proof Eq. (3) is the best result to date. In the following we spell out the proof of () for S = / only, and refer to [9] for the general case and additional details. For short, we denote f(/, ) by f(). Bosonic representation. It is well known that the Heisenberg Hamiltonian can be rewritten in terms of bosonic creation and annihilation operators [0]. The spin Hilbert space is mapped onto the bosonic Fock space with the additional constraint that there is at most one particle per site. For any x Λ we set S + x = a x( n x ), S x = ( n x )a x, S 3 x = n x, where a x, a x are bosonic creation and annihilation operators, n x = a xa x and S ± = S ± is. The Hamiltonian H Λ in () can be expressed as H Λ = P ] [(a x a y)(a x a y ) n x n y P (4) x,y Λ which we write as H Λ = P T P K, where P is a projection that enforces the hard-core constraint and K is the nearest neighbor density-density interaction. Upper bound. We localize the system into Dirichlet boxes of side l, to be optimized over: we pave Λ using cubes B of side l plus one-site-thick corridors between them. Since H Λ B Λ HD B, where HD B is the Hamiltonian with Sx 3 = / (i.e., Dirichlet) boundary conditions on B, f(, Λ) is bounded above by ( + l ) 3 f D (, B), with f D (, B) = Λ ln Tr e HD B. In each box B, we use the Gibbs variational principle: f D (, B) = [ l 3 min Tr HB D Γ + ] Γ Tr Γ ln Γ where one minimizes over normalized density matrices. In order to get an upper bound on the right side, we use as trial state Γ 0 = P e T D P/(normalization), where T D is the hopping term with Dirichlet boundary conditions, P = x P x and P x projects onto n x. The key observation is that one can get rid of the projectors by exploiting the simple inequality P x ( P x) nx (n x ). Wick s rule for Gaussian states can then be applied to compute the error due to the hard-core constraint. If l, the result is that f() l 3 ln( e ε(p) ) + O( 3 ) + O(l 3 / ) p where the sum runs over the Dirichlet wave vectors in the box B. The error for replacing the discrete Riemann sum by the corresponding integral is O(l ). optimal choice of l is then l 7/8, so that ( f() C 3/ 0 ) ( ) 5/ O( 3/8 ). The Lower bound. The proof is divided into three steps: localization and preliminary lower bound; restriction of the trace to the low-energy sector; estimate of the interaction in the low-energy sector. Step. We localize the system into boxes B of side l, to be optimized over: dropping the positive interaction between different boxes we get f(, Λ) f(, B). (5) We now derive a preliminary bound on the free energy of the form f(, B) (const.) 5/ (ln ) 5/, which relies on the following key lemma. It quantifies the minimal energy of states with total spin smaller than the maximum. Apart from the prefactor, it verifies the prediction of spin wave theory. We denote by S T the quantum number associated to the total spin operator S T = x B S x, i.e., S T = S T (S T + ). Lemma. H B (const.)l ( l3 S T ). Proof. For distinct sites x, y, z we first prove that ( x S y + y S z 4 S ) x S z, which is equivalent to 4 S x + S z S y (S x + S z ) 0. The operator S x + S z has only eigenvalues 0 and : in the first case the inequality is trivially true, while in the second it is sufficient to observe that S y (S x + S z ) has maximal eigenvalue /. By repeatedly applying the above inequality, one finds that for any n+ distinct sites ( x j S xj+ n 4 S ) x S xn+. (6) j For any given pair of sites x and y, we pick the shortest lattice path connecting the two points that stays as close as possible to the straight line from x to y (call it C x,y ), and estimate ( 4 S ) ( x S y 6l 4 S ) x S y Nx,y, x y x y = where N x,y denotes the number of paths among all the C z,z, z, z B, that contain the step x y. Since the left side equals l3 ( l3 + ) S T (S T + ) and N x,y (const.)l 4, this immediately implies the desired result. The strategy of the proof above can also be used to infer (3): using (6), we can bound the left side of (3) by twice the square of the number of bonds needed for reaching x from y on the lattice, times the bond energy. This leads to the right side of (3), with the factor 7 8 replaced by 6. A closer inspection yields the stated constant.

3 3 Lemma immediately implies an upper bound on the partition function: the number of states with total spin S T = l3 N is (( ) ( )) l (l 3 3 l 3 N + ) N N and is smaller than (l 3 + ) ( l 3 N), hence Tr(e H B ) (l 3 + )( + e (const.)l ) l3. Picking l / ln and using (5), we find f(, Λ) (const.) 5/ (ln ) 5/, (7) which is valid in domains Λ of side larger than / ln. Step. From now on we choose boxes of side l = /+ε with ε > 0 a small parameter to be optimized in the following. We use (7) to cut off the high-energy sector: if χ(condition) is the characteristic function of the set where condition is verified, Tr χ(h B E 0 )e H B e E0/ e l3 f(/,b). By (7), this is smaller than if E 0 = Cl 3 5/ (ln ) 5, for a suitable C > 0. We are left with the trace restricted to H B E 0, which we compute in sectors at fixed S T and ST 3. Because of SU() invariance, the result is independent of ST 3, which we can thus take to be minimal, i.e., ST 3 = S T. The degeneracy factor S T + can be bounded by l 3 + and, therefore, Tr χ(h B E 0 )e H B (l 3 + ) Tr E0 e H B, (8) where Tr E0 indicates the trace in the subspace H E0 with H B E 0 and ST 3 = S T. On this subspace we pass to the bosonic representation (4). In this representation the total number of particles equals N = l3 S T, which by Lemma is bounded above by (const.)l H B. It is worth stressing that, by fixing l = /+ε, the energy cut-off is E 0 l +O(ε) and hence the particle number in H E0 is smaller than l O(ε). By means of the Peierls-Bogoliubov inequality, Tr E0 e H B Tr E0 e T e K E 0 (9) where K E0 = Tr E0 Ke T / Tr E0 e T. We are left with deriving an upper bound on K E0. Step 3. In order to bound the mean value of the interaction, we first estimate E K E = x,y B E n x n y E 3l 3 max x,y ρ E(x, y), where E is an eigenstate of H B in H E0 with energy E and ρ E (x, y) is the diagonal part of the corresponding two-particle density matrix. The key estimate that we use is the following. Lemma. max x,y ρ E (x, y) (const.)e 5 l 4. Using this and recalling that l = /+ε and E E 0 l +O(ε), we conclude that K E0 (const.)l 3+O(ε). We now plug this bound into (9). The term Tr E0 e T gives rise to the (Riemann sum approximation to the) desired contribution to the free energy, while the other terms are subdominant corrections. Optimizing over l we find l = /40 and we get the lower bound f() C 0 ( ) 3/ 5/ ( O( κ ) ) with κ < /40. We now turn to the proof of Lemma. Proof of Lemma. We first show that the eigenvalue equation implies the following remarkable inequality for ρ E (x, y): ρ E (x, y) 4Eρ E (x, y), (0) where is the Neumann Laplacian on the set {(x, y) : x, y B, x y}: ρ E (x, y) = [ρ E (x, y) ( δ x,y) ρ E (x, y)] x x = + y y = [ρ E (x, y) ( δ y,x) ρ E (x, y )]. To prove this, rewrite (4) as [ a x ( n y ) a y( n x ) ] a x ( n y ), where the sum is now over all ordered nearest neighbor pairs in B. Note that now the model looks like a system of hopping hard-core bosons, with the exclusion condition that they cannot hop on occupied sites and no additional interaction. A simple computation starting from E H Λ a x a x a x a x E = E E a x a x a x a x E shows that Eρ E (x, x ) = E [ a x( n y ) a y( n x ) ] ( ) a x a x a x a x + δ x,x n x + δ x,x n x ax ( n y ) E. The contribution of the first term a x a x a x a x in the middle parenthesis is non-negative after summing over all pairs (x, y), and can hence be dropped for a lower bound. For the remaining two terms, we rewrite a x ( n y ) as [a x( n y ) a y ( n x )]+ [a x( n y ) + a y ( n x )] and observe that the contribution of the first term yields again a non-negative expression. Hence we get the lower bound 4Eρ E (x, x ) 4 E [ a x( n y ) a y( n x ) ] (δ x,x n x + δ x,x n x ) [a x ( n y ) + a y ( n x )] E.

4 4 Elementary algebraic manipulations show that the right side is equal to ρ E (x, x ), as desired. We now explain how to infer Lemma from (0). We extend ρ E to all of Z 3 Z 3 by reflections about the boundary of B and by letting ρ E (x, x) = 0 on the diagonal: more precisely, for m Z 6 we define the m-th image point under reflections of a point z = (z,..., z 6 ) B as z j (m j ) = m j l + (l ) + ( ( )mj zj (l )) and we let ρ( z( m)) ρ E ( z). This function satisfies for any z = (z, z ) Z 6 ρ( z) 4Eρ( z) + ρ( z)χ R ( z) where is the lattice Laplacian on Z 6 and χ R (z, z ) is equal to if z is at distance from one of the images of z, and 0 otherwise. It plays the role of an interaction potential, which is non-local due to the reflections. The last inequality can equivalently be written as ρ( z) ( E/3) ( ρ ( z) + 6 ρ( z)χr ( z) ) where ( z) means averaging over nearest neighbors in Z 6. In the last term on the right we bound ρ( z) by ρ = max x,y ρ(x, y). If we iterate n times, we further obtain ( denoting the convolution) ρ( z) ( E/3) n ((P n ρ)( z)+ 6 ρ n ) P j χ R ( z) j=0 () where P n ( z, z ) denotes the probability that a simple symmetric random walk on Z 6 starting at z ends up at z in n steps. The idea used to derive a bound on ρ starting from () is most transparent in the slightly simplified case where χ R is replaced by χ, the characteristic function of the set { z = (z, z ) : z z = }. To treat the actual case, an additional argument is required [9], showing that the finite size of B and the non-local part of the interaction χ R have a negligible effect on the magnitude of ρ. We pick n E in such a way that ( E/3) n + δ, with δ a fixed small constant. From the central limit theorem, P n ( z, z ) (3/(πn)) 3 e 3 z z /n. Therefore, (P n ρ)( z) can be bounded from above by (const.)e 3 x,y B ρ E(x, y), which is smaller than (const.)e 5 l 4, since the particle number is dominated by El thanks to Lemma. Moreover n j=0 P j( z, z ) j=0 P j( z, z ) = G( z z ), where G is the Green s function of the Laplacian on Z 6. Therefore, replacing χ R by χ in (), we find that the last term in () is bounded by ρ G χ( z). We have (G χ) (z, z ) = e ip(z z) 3 i= cos p i dp 3 i= ( cos p i) (π) 3 which is smaller than 0.58, its value at z = z. Putting things together, we have shown that ρ( z) is bounded by (const.)e 5 l ( + δ) ρ. If we choose δ so small that 0.58 ( + δ) <, Lemma follows. Conclusions. We report the first rigorous justification of the spin wave approximation for a quantum system with non-abelian continuous symmetry. We give precise bounds on the free energy at low temperatures, and establish spin order on suitable length scales. The research leading to these results has received funding from the European Research Council under the European Union s Seventh Framework Programme ERC Starting Grant CoMBoS (grant agreement n o 39694). M.C. acknowledges support from FIR grant Cond- Math RBFR3WAET. [] F. Bloch, Z. Phys. 6, 06-9 (930); and Z. Phys. 74, (93). [] B. E. Argyle, S. H. Charap, and E. W. Pugh, Phys. Rev. 3, 05 (963). [3] V. Zapf, M. Jaime, C. D. Batista, Rev. Mod. Phys. 86, (04). [4] Bose-Einstein condensation in quantum magnets is sometimes referred to as magnon condensation, a notion that should be properly interpreted, see J.L. Birman, R.G. Nazmitdinov, V.I. Yukalov, Phys. Rep. 56, -9 (03); V.I. Yukalov, Laser Physics, (0). [5] E. Della Torre, L. H. Bennett, and R. E. Watson, Phys. Rev. Lett. 94, 470 (005). [6] S. O. Demokritov et al., Nature 443, 430 (006). [7] F. Li, W. M. Saslow, and V. L. Pokrovsky, Scientific Reports 3, 37 (03). [8] T. Nikuni et al., Phys. Rev. Lett. 84, 5868 (000). [9] T. Giamarchi, C. Rëgg, and O. Tchernyshyov, Nature Phys. 4, 98 (008). [0] K. De Bell, A. B. MacIsaac, and J. P. Whitehead, Rev. Mod. Phys. 7, 5 (000). [] J. Bricmont et al, Commun. Math. Phys. 78, 545 (98). [] F.J. Dyson, E.H. Lieb, B. Simon, (a) Phys. Rev. Lett. 37, 0 (976); (b) J. Stat. Phys. 8, 335 (978). In (a), the authors announced a rigorous proof of the existence of a phase transition in the quantum Heisenberg ferromagnet in 3D, but later they recognized that their proof applies only to the anti-ferromagnet, as discussed in (b). [3] J. Fröhlich, B. Simon, T. Spencer, Commun. Math. Phys. 50, 79 (976). [4] J. Fröhlich, T. Spencer, Commun. Math. Phys. 83, 4 (98). [5] T. Kennedy, C. King, Commun. Math. Phys. 04, 37 (986). [6] G.J. Conlon, J.P. Solovej, Lett. Math. Phys. 3, 3 (99). [7] B. Toth, Lett. Math. Phys. 8, 75 (993). [8] M. Correggi, A. Giuliani, J. Stat. Phys. 49, 34 (0). [9] M. Correggi, A. Giuliani, R. Seiringer, arxiv:

5 5 [0] T. Holstein, H. Primakoff, Phys. Rev. 58, 098 (940). In the original Holstein-Primakoff representation the operator n x is replaced by n x/(s) in the definition of the bosonic operators, but for S = / the two operators coincide.