Quantum dynamics of the Neel vector in the antiferromagnetic molecular wheel CsFe8

The inelastic neutron scattering (INS) spectrum is studied for the antiferromagnetic molecular wheel CsFe8, in the temperature range 2 - 60 K, and for transfer energies up 3.6 meV. A qualitative analysis shows that the observed peaks correspond to the transitions between the L-band states, from the ground state up to the S = 5 multiplet. For a quantitative analysis, the wheel is described by a microscopic spin Hamiltonian (SH), which includes the nearest-neighbor Heisenberg exchange interactions and uniaxial easy-axis single-ion anisotropy, characterized by the constants J and D, respectively. For a best-fit determination of J and D, the L band is modeled by an effective SH, and the effective SH concept extended such as to facilitate an accurate calculation of INS scattering intensities, overcoming difficulties with the dimension of the Hilbert space. The low-energy magnetism in CsFe8 is excellently described by the generic SH used. The two lowest states are characterized by a tunneling of the Neel vector, as found previously, while the higher-lying states are well described as rotational modes of the Neel vector.Comment: 12 pages, 10 figures, REVTEX4, to appear in PR

Many-spin effects in inelastic neutron scattering and electron paramagnetic resonance of molecular nanomagnets

Many molecular magnetic clusters, such as single-molecule magnets, are characterized by spin ground states with defined total spin S exhibiting zero-field-splittings. In this work, the spectroscopic intensities of the transitions within the ground-state multiplet are analyzed. In particular, the effects of a mixing with higher-lying spin multiplets, which is produced by anisotropic interactions and is neglected in the standard single-spin description, are investigated systematically for the two experimental techniques of inelastic neutron scattering (INS) and electron paramagnetic resonance (EPR), with emphasis on the former technique. The spectroscopic transition intensities are calculated analytically by constructing corresponding effective spin operators perturbationally up to second order and consequently using irreducible tensor operator techniques. Three main effects of spin mixing are observed. Firstly, a pronounced dependence of the INS intensities on the momentum transfer Q, with a typical oscillatory behavior, emerges in first order, signaling the many-spin nature of the wave functions in exchange-coupled clusters. Secondly, as compared to the results of a first-order calculation, the intensities of the transitions within the spin multiplet are affected differently by spin mixing. This allows one, thirdly, to differentiate the higher-order contributions to the cluster magnetic anisotropy which come from the single-ion ligand-field terms and spin mixing, respectively. The analytical results are illustrated by means of the three examples of an antiferromagnetic heteronuclear dimer, the Mn-[3 x 3] grid molecule, and the single-molecule magnet Mn12.Comment: 18 pages, 3 figures, REVTEX4, to appear in PR

Exchange-coupling constants, spin density map, and Q dependence of the inelastic neutron scattering intensity in single-molecule magnets

The Q dependence of the inelastic neutron scattering (INS) intensity of transitions within the ground-state spin multiplet of single-molecule magnets (SMMs) is considered. For these transitions, the Q dependence is related to the spin density map in the ground state, which in turn is governed by the Heisenberg exchange interactions in the cluster. This provides the possibility to infer the exchange-coupling constants from the Q dependence of the INS transitions within the spin ground state. The potential of this strategy is explored for the M = +-10 -> +- 9 transition within the S = 10 multiplet of the molecule Mn12 as an example. The Q dependence is calculated for powder as well as single-crystal Mn12 samples for various exchange-coupling situations discussed in the literature. The results are compared to literature data on a powder sample of Mn12 and to measurements on an oriented array of about 500 single-crystals of Mn12. The calculated Q dependence exhibits significant variation with the exchange-coupling constants, in particular for a single-crystal sample, but the experimental findings did not permit an unambiguous determination. However, although challenging, suitable experiments are within the reach of today's instruments.Comment: 11 pages, 6 figures, REVTEX4, to appear in PR

A spatially resolved limb flare on Algol B observed with XMM-Newton

We report XMM-Newton observations of the eclipsing binary Algol A (B8V) and B (K2III). The XMM-Newton data cover the phase interval 0.35 - 0.58, i.e., specifically the time of optical secondary minimum, when the X-ray dark B-type star occults a major fraction of the X-ray bright K-type star. During the eclipse a flare was observed with complete light curve coverage. The decay part of the flare can be well described with an exponential decay law allowing a rectification of the light curve and a reconstruction of the flaring plasma region. The flare occurred near the limb of Algol B at a height of about 0.1R with plasma densities of a few times 10^11 cm^-3 consistent with spectroscopic density estimates. No eclipse of the quiescent X-ray emission is observed leading us to the conclusion that the overall coronal filling factor of Algol B is small.Comment: 8 pages, 7 figures, accepted by A&

Magnetic relaxation studies on a single-molecule magnet by time-resolved inelastic neutron scattering

Time-resolved inelastic neutron scattering measurements on an array of single-crystals of the single-molecule magnet Mn12ac are presented. The data facilitate a spectroscopic investigation of the slow relaxation of the magnetization in this compound in the time domain.Comment: 3 pages, 4 figures, REVTEX4, to appear in Appl. Phys. Lett., for an animation see also http://www.dcb.unibe.ch/groups/guedel/members/ow2/trins.ht

Quantum Phase Interference and Neel-Vector Tunneling in Antiferromagnetic Molecular Wheels

The antiferromagnetic molecular wheel Fe18 of eighteen exchange-coupled Fe(III) ions has been studied by measurements of the magnetic torque, the magnetization, and the inelastic neutron scattering spectra. The combined data show that the low-temperature magnetism of Fe18 is very accurately described by the Neel-vector tunneling (NVT) scenario, as unfolded by semiclassical theory. In addition, the magnetic torque as a function of applied field exhibits oscillations that reflect the oscillations in the NVT tunnel splitting with field due to quantum phase interference.Comment: 5 pages, 4 figures, REVTEX4, to appear in PR

Spin anisotropy effects in dimer single molecule magnets

We present a model of equal spin $s_1$ dimer single molecule magnets. The spins within each dimer interact via the Heisenberg and the most general set of four quadratic anisotropic spin interactions with respective strengths $J$ and $\{J_j\}$, and with the magnetic induction ${\bf B}$. We solve the model exactly for $s_1=1/2, 1, 5/2$, and for antiferromagnetic Heisenberg couplings ($J<0$), present ${\bf M}({\bf B})$ curves at low $T$ for these cases. Low-$T$ $C_V({\bf B})$ curves for $s_1=1/2$ and electron paramagnetic susceptibility $\chi({\bf B},\omega)$ for $s_1=1$ are also provided. For weak anisotropy interactions, we employ a perturbative treatment, and show that the Hartree and extended Hartree approximations lead to reliable analytic results at low $T$ and large $B$ for these quantities and for the inelastic neutron scattering cross-section $S({\bf B}, {\bf q},\omega)$. Our results are discussed with regard to existing ${\bf M}({\bf B})$ experiments on $s_1=5/2$ Fe$_2$ dimer single molecule magnets, and suggest that one of them contains a substantial amount of single-ion anisotropy, without any sizeable global spin anisotropy. We urge further experiments of the above types on single crystals of Fe$_2$ and on some $s_=9/2$ [Mn$_4$]$_2$ dimers, in order to elucidate the precise values of the various microscopic interactions.Comment: 30 pages, 25 figures, submitted to Phys. Rev.

Relationship between X-ray and ultraviolet emission of flares from dMe stars observed by XMM-Newton

We present simultaneous ultraviolet and X-ray observations of the dMe-type flaring stars AT Mic, AU Mic, EV Lac, UV Cet and YZ CMi obtained with the XMM-Newton observatory. During 40 hours of simultaneous observation we identify 13 flares which occurred in both wave bands. For the first time, a correlation between X-ray and ultraviolet flux for stellar flares has been observed. We find power-law relationships between these two wavelength bands for the flare luminosity increase, as well as for flare energies, with power-law exponents between 1 and 2. We also observe a correlation between the ultraviolet flare energy and the X-ray luminosity increase, which is in agreement with the Neupert effect and demonstrates that chromospheric evaporation is taking place.Comment: 8 pages, 4 figures, 3 tables, accepted by A&A (30 Sept. 2004