New high field magnet for neutron scattering at Hahn Meitner Institute

Abstract The Berlin Neutron Scattering Center BENSC at the Hahn Meitner Institute HMI is a user facility for the study of structure and dynamics of condensed matter with neutrons and synchrotron radiation with special emphasis on experiments under extreme conditions. Neutron scattering is uniquely suited to study magnetic properties on a microscopic length scale, because neutrons have comparable wavelengths and, due to their magnetic moment, they interact with the atomic magnetic moments. Magnetic interactions and magnetic phenomena depend on thermodynamic parameters like magnetic field, temperature and pressure. At HMI special efforts are being made to offer outstanding sample environments such as very low temperatures or high magnetic fields or combination of both. For the future a dedicated instrument for neutron scattering at extreme fields is under construction, the Extreme Environment Diffractometer ExED. For this instrument the existing superconducting magnets as well as a future hybrid system can be used. The highest fields, above 30 T will be produced by the planned series connected hybrid magnet system, designed and constructed in collaboration with the National High Magnetic Field Laboratory, Tallahassee, F

Finite-temperature perturbation theory for quasi-one-dimensional spin-1/2 Heisenberg antiferromagnets

We develop a finite-temperature perturbation theory for quasi-one-dimensional quantum spin systems, in the manner suggested by H.J. Schulz (1996) and use this formalism to study their dynamical response. The corrections to the random-phase approximation formula for the dynamical magnetic susceptibility obtained with this method involve multi-point correlation functions of the one-dimensional theory on which the random-phase approximation expansion is built. This ``anisotropic'' perturbation theory takes the form of a systematic high-temperature expansion. This formalism is first applied to the estimation of the N\'eel temperature of S=1/2 cubic lattice Heisenberg antiferromagnets. It is then applied to the compound Cs$_2$CuCl$_4$, a frustrated S=1/2 antiferromagnet with a Dzyaloshinskii-Moriya anisotropy. Using the next leading order to the random-phase approximation, we determine the improved values for the critical temperature and incommensurability. Despite the non-universal character of these quantities, the calculated values are different by less than a few percent from the experimental values for both compounds.Comment: 11 pages, 6 figure

Comparison of the biotypes of Yersinia enterocolitica isolated from pigs, cattle and sheep at slaughter and from humans with yersiniosis in Great Britain during 1999-2000

Aims: To investigate the relationship between livestock carriage of Yersinia enterocolitica and human disease. The biotypes/serotypes of strains recovered from the faeces of pigs, cattle and sheep at slaughter during a national survey in Great Britain in 1999-2000, were compared with those of strains isolated from human cases of yersiniosis during the same period. Methods and Results: The faecal carriage of Y. enterocolitica by cattle, sheep and pigs at slaughter was 6.3, 10.7 and 26.1%, respectively. Yersinia enterocolitica biotype (BT) 1a was the most frequently isolated biotype from livestock (58%) and was the predominant biotype (53%) isolated from human cases over the same period. The main recognized pathogenic Y. enterocolitica biotype isolated from livestock was BT3 (O:5,27) (35% of sheep, 22% of pigs and 4% of cattle) but this biotype was not detected in any of the human isolates investigated. The major pathogenic biotypes of strains isolated from humans were BT3 (O:9) (24%) and BT4 (O:3) (19%) whereas of the veterinary isolates investigated, only pigs (11%) carried BT3 (O:9) strains. Conclusions: Because of significant overlaps in phenotypes of the veterinary and human strains it is not possible to comment on the correlation between host and pathogenicity, especially of biotype 1a. Significance and Impact of the Study: The data suggest that further investigations using methods with greater discriminatory power are required. However the data also suggests that pigs may be the primary reservoir for human pathogenic Y. enterocolitica infection

Anomalous dynamical line shapes in a quantum magnet at finite temperature

The effect of thermal fluctuations on the dynamics of a gapped quantum magnet is studied using inelastic neutron scattering on copper nitrate, a model material for the spin-1/2, one-dimensional (1D) bond alternating Heisenberg chain. A large, highly deuterated, single-crystal sample of copper nitrate is produced using a solution growth method and measurements are made using the high-resolution backscattering spectrometer OSIRIS at the ISIS Facility. Theoretical calculations and numerical analysis are combined to interpret the physical origin of the thermal effects observed in the magnetic spectra. The primary observations are (1) a thermally induced central peak due to intraband scattering, which is similar to Villain scattering familiar from soliton systems in 1D, and (2) the one-magnon quasiparticle pole is seen to develop with temperature into an asymmetric continuum of scattering. We relate this asymmetric line broadening to a thermal strongly correlated state caused by hard-core constraints and quasiparticle interactions. These findings are a counter example to recent assertions of the universality of line broadening in 1D systems and are applicable to a broad range of quantum systems

Temperature dependence of single particle excitations in a S=1 chain: exact diagonalization calculations compared to neutron scattering experiments

Exact diagonalization calculations of finite antiferromagnetic spin-1 Heisenberg chains at finite temperatures are presented and compared to a recent inelastic neutron scattering experiment for temperatures T up to 7.5 times the intrachain exchange constant J. The calculations show that the excitations at the antiferromagnetic point q=1 and at q=0.5 remain resonant up to at least T=2J, confirming the recent experimental observation of resonant high-temperature domain wall excitations. The predicted first and second moments are in good agreement with experiment, except at temperatures where three-dimensional spin correlations are most important. The ratio of the structure factors at q=1 and at q=0.5 is well predicted for the paramagnetic infinite-temperature limit. For T=2J, however, we found that the experimentally observed intensity is considerably less than predicted. This suggests that domain wall excitations on different chains interact up to temperatures of the order of the spin band width.Comment: 9 pages revtex, submitted to PR

Coexistence of double alternating antiferromagnetic chains in (VO)_2P_2O_7 : NMR study

Nuclear magnetic resonance (NMR) of 31P and 51V nuclei has been measured in a spin-1/2 alternating-chain compound (VO)_2P_2O_7. By analyzing the temperature variation of the 31P NMR spectra, we have found that (VO)_2P_2O_7 has two independent spin components with different spin-gap energies. The spin gaps are determined from the temperature dependence of the shifts at 31P and 51V sites to be 35 K and 68 K, which are in excellent agreement with those observed in the recent inelastic neutron scattering experiments [A.W. Garrett et al., Phys. Rev. Lett. 79, 745 (1997)]. This suggests that (VO)_2P_2O_7 is composed of two magnetic subsystems showing distinct magnetic excitations, which are associated with the two crystallographically-inequivalent V chains running along the b axis. The difference of the spin-gap energies between the chains is attributed to the small differences in the V-V distances, which may result in the different exchange alternation in each magnetic chain. The exchange interactions in each alternating chain are estimated and are discussed based on the empirical relation between the exchange interaction and the interatomic distance.Comment: 10 pages, 11 embedded eps figures, REVTeX, Submitted to Phys. Rev.

A microscopic model for a class of mixed-spin quantum antiferromagnets

We propose a microscopic model that describes the magnetic behavior of the mixed-spin quantum systems R$_2$BaNiO$_5$ (R= magnetic rare earth). An evaluation of the properties of this model by Quantum Monte Carlo simulations shows remarkable good agreement with the experimental data and provides new insight into the physics of mixed-spin quantum magnets.Comment: revised version to be published in Phys. Rev.

A Study of the S=1/2 Alternating Chain using Multiprecision Methods

In this paper we present results for the ground state and low-lying excitations of the $S=1/2$ alternating Heisenberg antiferromagnetic chain. Our more conventional techniques include perturbation theory about the dimer limit and numerical diagonalization of systems of up to 28 spins. A novel application of multiple precision numerical diagonalization allows us to determine analytical perturbation series to high order; the results found using this approach include ninth-order perturbation series for the ground state energy and one magnon gap, which were previously known only to third order. We also give the fifth-order dispersion relation and third-order exclusive neutron scattering structure factor for one-magnon modes and numerical and analytical binding energies of S=0 and S=1 two-magnon bound states.Comment: 16 pages, 9 figures. for submission to Phys.Rev.B. PICT files of figs available at http://csep2.phy.ornl.gov/theory_group/people/barnes/barnes.htm

Heisenberg Dimer Single Molecule Magnets in a Strong Magnetic Field

We calculate the static and dynamic properties of single crystal, single molecule magnets consisting of equal spin $S=1/2$ or 5/2 dimers. The spins in each dimer interact with each other via the Heisenberg exchange interaction and with the magnetic induction ${\bf B}$ via the Zeeman interaction, and interdimer interactions are negligible. For antiferromagnetic couplings, the static magnetization and specific heat exhibit interesting low temperature $T$ and strong ${\bf B}$ quantum effects. We calculate the frequency spectrum of the Fourier transform of the real part of the time autocorrelation function ${\cal C}_{11}(t)$ for arbitrary $T, {\bf B}$, and compare our results with those obtained for classical spins. We also calculate the inelastic neutron magnetic dynamical structure factor $S({\bf q},\omega)$ at arbitrary $T, {\bf B}$.Comment: 11 pages, 14 figures, submitted to Phys. Rev.

Magnon-magnon interactions in the Spin-Peierls compound CuGeO_3

In a magnetic substance the gap in the Raman spectrum, Delta_R, is approximatively twice the value of the neutron scattering gap, Delta_S, if the the magnetic excitations (magnons) are only weakly interacting. But for CuGeO_3 the experimentally observed ratio Delta_R/Delta_S is approximatively 1.49-1.78, indicating attractive magnon-magnon interactions in the quasi-1D Spin-Peierls compound CuGe_3. We present numerical estimates for Delta_R/Delta_S from exact diagonalization studies for finite chains and find agreement with experiment for intermediate values of the frustration parameter alpha. An analysis of the numerical Raman intensity leads us to postulate a continuum of two-magnon bound states in the Spin-Peierls phase. We discuss in detail the numerical method used, the dependence of the results on the model parameters and a novel matrix-element effect due to the dimerization of the Raman-operator in the Spin-Peierls phase.Comment: submitted to PRB, Phys. Rev. B, in pres