Impurities in S=1/2 Heisenberg Antiferromagnetic Chains: Consequences for Neutron Scattering and Knight Shift

Non-magnetic impurities in an S=1/2 Heisenberg antiferromagnetic chain are studied using boundary conformal field theory techniques and finite-temperature quantum Monte Carlo simulations. We calculate the static structure function, S_imp(k), measured in neutron scattering and the local susceptibility, chi_i measured in Knight shift experiments. S_imp(k) becomes quite large near the antiferromagnetic wave-vector, and exhibits much stronger temperature dependence than the bulk structure function. \chi_i has a large component which alternates and increases as a function of distance from the impurity.Comment: 8 pages (revtex) + one postscript file with 6 figures. A complete postscript file with all figures + text (10pages) is available from http://fy.chalmers.se/~eggert/struct.ps or by request from [email protected] Submitted to Phys. Rev. Let

Local Magnetic Susceptibility of the Positive Muon in the Quasi 1D S=1/2 Antiferromagnet KCuF3_3

We report muon spin rotation measurements of the local magnetic susceptibility around a positive muon in the paramagnetic state of the quasi one-dimensional spin 1/2 antiferromagnet KCuF$_3$. Signals from two distinct sites are resolved which have a temperature dependent frequency shift which is different than the magnetic susceptibility. This difference is attributed to a muon induced perturbation of the spin 1/2 chain.Comment: 13 pages, 4 figures, The 2002 International Conference on Muon Spin Rotation, Relaxation and Resonance, Virginia. US

Neel order in doped quasi one-dimensional antiferromagnets

We study the Neel temperature of quasi one-dimensional S=1/2 antiferromagnets containing non-magnetic impurities. We first consider the temperature dependence of the staggered susceptibility of finite chains with open boundary conditions, which shows an interesting difference for even and odd length chains. We then use a mean field theory treatment to incorporate the three dimensional inter-chain couplings. The resulting Neel temperature shows a pronounced drop as a function of doping by up to a factor of 5.Comment: 4 pages in revtex4 format including 2 epsf-embedded figures. The latest version in PDF format is available from http://fy.chalmers.se/~eggert/papers/staggered.pd

Lattice vs. continuum theory of the periodic Heisenberg chain

We consider the detailed structure of low energy excitations in the periodic spin-1/2 XXZ Heisenberg chain. By performing a perturbative calculation of the non-linear corrections to the Gaussian model, we determine the exact coefficients of asymptotic expansions in inverse powers of the system length N for a large number of low-lying excited energy levels. This allows us to calculate eigenenergies of the lattice model up to order order N^-4, without having to solve the Bethe Ansatz equations. At the same time, it is possible to express the exact eigenstates of the lattice model in terms of bosonic modes.Comment: 17 pages, 8 Figures. The latest version can be found at http://www.physik.uni-kl.de/eggert/papers/index.htm

Numerical Evidence for Multiplicative Logarithmic Corrections from Marginal Operators

Field theory calculations predict multiplicative logarithmic corrections to correlation functions from marginally irrelevant operators. However, for the numerically most suitable model - the spin-1/2 chain - these corrections have been controversial. In this paper, the spin-spin correlation function of the antiferromagnetic spin-1/2 chain is calculated numerically in the presence of a next nearest neighbor coupling J2 for chains of up to 32 sites. By varying the coupling strength J2 we can control the effect of the marginal operator, and our results unambiguously confirm the field theory predictions. The critical value at which the marginal operator vanishes has been determined to be at J2 = 0.241167 +/- 0.000005J.Comment: revised paper with extended data-analysis. 5 pages, using revtex with 4 embedded figures (included with macro). A complete postscript file with all figures + text (5 pages) is available from http://FY.CHALMERS.SE/~eggert/marginal.ps or by request from [email protected]

Spin- and charge-density oscillations in spin chains and quantum wires

We analyze the spin- and charge-density oscillations near impurities in spin chains and quantum wires. These so-called Friedel oscillations give detailed information about the impurity and also about the interactions in the system. The temperature dependence of these oscillations explicitly shows the renormalization of backscattering and conductivity, which we analyze for a number of different impurity models. We are also able to analyze screening effects in one dimension. The relation to the Kondo effect and experimental consequences are discussed.Comment: Final published version. 15 pages in revtex format including 22 epsf-embedded figures. The latest version in PDF format is available from http://fy.chalmers.se/~eggert/papers/density-osc.pd

Chain breaks and the susceptibility of Sr_2Cu_{1-x}Pd_xO_{3+\delta} and other doped quasi one-dimensional antiferromagnets

We study the magnetic susceptibility of one-dimensional S=1/2 antiferromagnets containing non-magnetic impurities which cut the chain into finite segments. For the susceptibility of long anisotropic Heisenberg chain-segments with open boundaries we derive a parameter-free result at low temperatures using field theory methods and the Bethe Ansatz. The analytical result is verified by comparing with Quantum-Monte-Carlo calculations. We then show that the partitioning of the chain into finite segments can explain the Curie-like contribution observed in recent experiments on Sr_2Cu_{1-x}Pd_xO_{3+\delta}. Possible additional paramagnetic impurities seem to play only a minor role.Comment: 4 pages, 3 figures, final versio