The contribution to the entanglement of an impurity attached to one end of a J – J 2 –δ quantum spin chain ( S = 1/2) is studied. Two different measures of the impurity contribution to the entanglement have been proposed: the impurity entanglement entropy S imp and the negativity . The first, S imp , is based on a subtractive procedure where the entanglement entropy in the absence of the impurity is subtracted from results with the impurity present. The other, , is the negativity of a part of the system separated from the impurity and the impurity itself. In this paper we compare the two measures and discuss their similarities and the differences between them. In the J – J 2 –δ model it is possible to perform very precise variational calculations close to the Majumdar–Ghosh point ( J 2 = J /2 and δ = 0) where the system is gapped with a dimerized ground state. We describe in detail how such calculations are done and how they can be used to calculate as well as S imp for any impurity coupling J K . We then study the complete crossover in the impurity entanglement as J K is varied between 0 and 1 close to the Majumdar–Ghosh point. In particular, we study the impurity entanglement when a staggered nearest neighbour interaction proportional to δ is introduced. In this case we observe a very rapid reduction in the impurity entanglement as δ is increased.
The contribution to the entanglement of an impurity attached to one end of a J – J 2 –δ quantum spin chain ( S = 1/2) is studied. Two different measures of the impurity contribution to the entanglement have been proposed: the impurity entanglement entropy S imp and the negativity . The first, S imp , is based on a subtractive procedure where the entanglement entropy in the absence of the impurity is subtracted from results with the impurity present. The other, , is the negativity of a part of the system separated from the impurity and the impurity itself. In this paper we compare the two measures and discuss their similarities and the differences between them. In the J – J 2 –δ model it is possible to perform very precise variational calculations close to the Majumdar–Ghosh point ( J 2 = J /2 and δ = 0) where the system is gapped with a dimerized ground state. We describe in detail how such calculations are done and how they can be used to calculate as well as S imp for any impurity coupling J K . We then study the complete crossover in the impurity entanglement as J K is varied between 0 and 1 close to the Majumdar–Ghosh point. In particular, we study the impurity entanglement when a staggered nearest neighbour interaction proportional to δ is introduced. In this case we observe a very rapid reduction in the impurity entanglement as δ is increased.
Entanglement in J 1 – J 2 , S = 1/2 quantum spin chains with an impurity is studied using analytic methods as well as large scale numerical density matrix renormalization group methods. The entanglement is investigated in terms of the von Neumann entropy, S = −Trρ A logρ A , for a subsystem A of size r of the chain. The impurity contribution to the uniform part of the entanglement entropy, S imp , is defined and analysed in detail in both the gapless, J 2 ≤ J 2 c , as well as the dimerized phase, J 2 > J 2 c , of the model. This quantum impurity model is in the universality class of the single channel Kondo model and it is shown that in a quite universal way the presence of the impurity in the gapless phase, J 2 ≤ J 2 c , gives rise to a large length scale, ξ K , associated with the screening of the impurity, the size of the Kondo screening cloud. The universality of Kondo physics then implies scaling of the form S imp ( r /ξ K , r / R ) for a system of size R . Numerical results are presented clearly demonstrating this scaling. At the critical point, J 2 c , an analytic approach based on a Fermi liquid picture, valid at distances and energy scales , is developed and analytic results at T = 0 are obtained showing S imp = πξ K [1+π(1− r / R )cot(π r / R )]/(12 R ) for finite R . For T >0, in the thermodynamic limit, we find S imp = [π 2 ξ K T /(6 v )]coth(2π rT / v ), with v the spin-wave velocity. In the dimerized phase an appealing picture of the entanglement is developed in terms of a thin soliton (TS) ansatz and the notions of impurity valence bonds (IVB) and single particle entanglement (SPE) are introduced. The TS-ansatz permits a variational calculation of the complete entanglement in the dimerized phase that appears to be exact in the thermodynamic limit at the Majumdar–Ghosh point, J 2 = J 1 /2, and surprisingly precise even close to the critical point J 2 c . In the appendices the TS-ansatz is further used to calculate and with high precision at the Majumdar–Ghosh point and the relation between the finite temperature entanglement entropy, S ( T ), and the thermal entropy, S th ( T ), is discussed. Finally, the alternating part of S imp is discussed, together with its relation to the boundary induced dimerization.
In this thesis I present three publications about the use of valence bonds to gain information about quantum spin systems. Valence bonds are an essential ingredient of low energy states present in many compounds. The first part of this thesis is dedicated to two studies of the antiferromagnetic J1-J2 chain with S=1/2. We show how automated variational calculations based on valence bond states can be performed close to the Majumdar-Ghosh point (MG-point). At this point, the groundstate is a product state of dimers (valence bonds between nearest neighbours). In the dimerized region surrounding the MG-point, we find such variational computations to be reliable. The first publication is about the entanglement properties of an impurity attached to the chain. We show how to use the variational method to calculate the negativity, an entanglement measure between the impurity and a distant part of the chain. We find that increasing the impurity coupling and a minute explicit dimerization, suppress the long-ranged entanglement present in the system for small impurity coupling at the MG-point. The second publication is about a transition from commensurate to incommensurate behaviour and how its characteristics depend on the parity of the length of the chain. The variational technique is used in a parameter regime inaccessible to DMRG. We find that in odd chains, unlike in even chains, a very intricate and interesting pattern of level crossings can be observed. The publication of the second part is about novel worm algorithms for a popular quantum Monte Carlo method called valence bond quantum Monte Carlo (VBQMC). The algorithms are based on the notion of a worm moving through a decision tree. VBQMC is entirely formulated in terms of valence bonds. In this thesis, I explain how the approach of VBQMC can be translated to the Sz-basis. The algorithms explained in the publication can be applied to this Sz-method.
Two electronic channels competing to screen a single impurity spin, as in the two-channel Kondo model, are expected to generate a ground state with a nontrivial entanglement structure. We exploit a spin-chain representation of the two-channel Kondo model to probe the ground-state block entropy, negativity, tangle, and Schmidt gap, using a density matrix renormalization group approach. In the presence of symmetric coupling to the two channels, we confirm field-theory predictions for the boundary entropy difference ln(gUV/gIR)=ln(2)/2 between the ultraviolet and infrared limits and the leading ln(x)/x impurity correction to the block entropy. The impurity entanglement Simp is shown to scale with the characteristic length ${\ensuremath{\xi}}_{2\text{CK}}$. We show that both the Schmidt gap and the entanglement of the impurity with one of the channels---as measured by the negativity---faithfully serve as order parameters for the impurity quantum phase transition appearing as a function of channel asymmetry, allowing for explicit determination of critical exponents, $\ensuremath{\nu}\ensuremath{\approx}2$ and $\ensuremath{\beta}\ensuremath{\approx}0.2$. Remarkably, we find the emergence of tripartite entanglement only in the vicinity of the critical channel-symmetric point.
Using the method of the Jordan–Wigner transformation for solving different spin–spin correlation functions, we have investigated the generation of next-nearest-neighbouring entanglement in a one-dimensional quantum Ising spin chain with the Gaussian distribution impurities of exchange couplings and external magnetic fields taken into account. The maximal value of entanglement between the next-nearest-neighbouring qubits in the transverse Ising model was analysed in detail by varying the effectively controlled parameters such as interchange coupling, magnetic field and the system impurity. For such systems, where both exchange couplings and external magnetic field disorder appear, we show that it is possible to achieve next-nearest-neighbouring entanglement better than the previously discussed pure Ising spin chain case. We also show that the Gaussian distribution impurity can induce next-nearest-neighbouring entanglement, which can be used as a means to characterize quantum phase transition.
Abstract The screening of an impurity spin in the Kondo model occurs over a characteristic length scale ξ K , that defines the size of the Kondo screening cloud or ‘mist’. The presence of such a length scale in experimental and numerical results is rather subtle. A consistent way to show the presence of the screening cloud is to demonstrate scaling in the spatial correlations in terms of the single variable, r / ξ K instead of the correlations depending on r and ξ K separately. Here we study the paradigmatic one channel Kondo model using a spin chain representation, with an impurity spin at one end of the chain coupled with a strength J K ′ . Using Fermi liquid theory combined with numerical results, we obtain new high precision estimates of the non-universal terms in the entanglement entropy which leads to a verification of the expected non-integer ground-state degeneracy, g. This then allows us to study the impurity contribution to the entanglement in detail. If the impurity coupling J K ′ is varied, a precise determination of ξ K can then be obtained. The length scale, ξ K , is then shown to characterize the scaling of both the uniform and alternating part of a measure of the magnetization of part of an odd length chain.
In order to quantify quantum entanglement in two-impurity Kondo systems, we calculate the concurrence, negativity, and von Neumann entropy. The entanglement of the two Kondo impurities is shown to be determined by two competing many-body effects, namely the Kondo effect and the Ruderman-Kittel-Kasuya-Yosida (RKKY) interaction, I. Due to the spin-rotational invariance of the ground state, the concurrence and negativity are uniquely determined by the spin-spin correlation between the impurities. It is found that there exists a critical minimum value of the antiferromagnetic correlation between the impurity spins which is necessary for entanglement of the two impurity spins. The critical value is discussed in relation with the unstable fixed point in the two-impurity Kondo problem. Specifically, at the fixed point there is no entanglement between the impurity spins. Entanglement will only be created [and quantum information processing (QIP) will only be possible] if the RKKY interaction exchange energy, I, is at least several times larger than the Kondo temperature, TK. Quantitative criteria for QIP are given in terms of the impurity spin-spin correlation.