Large quantum fluctuations in the strongly coupled spin-1/2 chains of green dioptase: a hidden message from birds and trees

The green mineral dioptase Cu6Si6O18(H2O)6 has been known since centuries and plays an important role in esoteric doctrines. In particular, the green dioptase is supposed to grant the skill to speak with trees and to understand the language of birds. Armed with natural samples of dioptase, we were able to unravel the magnetic nature of the mineral (presumably with hidden support from birds and trees) and show that strong quantum fluctuations can be realized in an essentially framework-type spin lattice of coupled chains, thus neither frustration nor low-dimensionality are prerequisites. We present a microscopic magnetic model for the green dioptase. Based on full-potential DFT calculations, we find two relevant couplings in this system: an antiferromagnetic coupling J_c, forming spiral chains along the hexagonal c axis, and an inter-chain ferromagnetic coupling J_d within structural Cu2O6 dimers. To refine the J_c and J_d values and to confirm the proposed spin model, we perform quantum Monte-Carlo simulations for the dioptase spin lattice. The derived magnetic susceptibility, the magnetic ground state, and the sublattice magnetization are in remarkably good agreement with the experimental data. The refined model parameters are J_c = 78 K and J_d = -37 K with J_d/J_c ~ -0.5. Despite the apparent three-dimensional features of the spin lattice and the lack of frustration, strong quantum fluctuations in the system are evidenced by a broad maximum in the magnetic susceptibility, a reduced value of the Neel temperature T_N ~ 15 K >> J_c, and a low value of the sublattice magnetization m = 0.55 Bohr magneton. All these features should be ascribed to the low coordination number of 3 that outbalances the three-dimensional nature of the spin lattice.Comment: Dedicated to Stefan-Ludwig Drechsler on the occasion of his 60th birthday (9 pages, 6 figures

Abundances of Na, Sc, Cr, Mn, Fe, Co, and Cu in 92 meteorites, 9 terrestrial specimens, and 90 individual chondrules Quarterly progress report, 1 Sep. - 30 Nov. 1963

Elemental abundancies in individual chondrules, chondrites and terrestrial matter, whole rock- type meteorites, and carbonaceous chondrite

Magnetism of CuX2 frustrated chains (X = F, Cl, Br): the role of covalency

Periodic and cluster density-functional theory (DFT) calculations, including DFT+U and hybrid functionals, are applied to study magnetostructural correlations in spin-1/2 frustrated chain compounds CuX2: CuCl2, CuBr2, and a fictitious chain structure of CuF2. The nearest-neighbor and second-neighbor exchange integrals, J1 and J2, are evaluated as a function of the Cu-X-Cu bridging angle, theta, in the physically relevant range 80-110deg. In the ionic CuF2, J1 is ferromagnetic for theta smaller 100deg. For larger angles, the antiferromagnetic superexchange contribution becomes dominant, in accord with the Goodenough-Kanamori-Anderson rules. However, both CuCl2 and CuBr2 feature ferromagnetic J1 in the whole angular range studied. This surprising behavior is ascribed to the increased covalency in the Cl and Br compounds, which amplifies the contribution from Hund's exchange on the ligand atoms and renders J1 ferromagnetic. At the same time, the larger spatial extent of X orbitals enhances the antiferromagnetic J2, which is realized via the long-range Cu-X-X-Cu paths. Both, periodic and cluster approaches supply a consistent description of the magnetic behavior which is in good agreement with the experimental data for CuCl2 and CuBr2. Thus, owing to their simplicity, cluster calculations have excellent potential to study magnetic correlations in more involved spin lattices and facilitate application of quantum-chemical methods

Critical properties of the one-dimensional spin-1/2 antiferromagnetic Heisenberg model in the presence of a uniform field

In the presence of a uniform field the one-dimensional spin-$\frac{1}{2}$ antiferromagnetic Heisenberg model develops zero frequency excitations at field-dependent 'soft mode' momenta. We determine three types of critical quantities, which we extract from the finite-size dependence of the lowest excitation energies, the singularities in the static structure factors and the infrared singularities in the dynamical structure factors at the soft mode momenta. We also compare our results with the predictions of conformal field theory.Comment: 12 pages, REVTEX, 7 figures, submitted to Physical Review

Rare Earth Abundances in Meteoritic Chondrules

Rare earth elements abundance in meteoritic chondrites determined by radiochemical neutron activation analysi

The Spectral Energy Distribution of Normal, Starburst and Active Galaxies

We present the results of an extensive literature search of multiwavelength data for a sample of 59 galaxies, consisting of 26 Starbursts, 15 Seyfert 2's, 5 LINER's, 6 normal spirals and 7 normal elliptical galaxies. The data include soft X-ray fluxes, ultraviolet and optical spectra, near, mid/far infrared photometry and radio measurements, selected to match as closely as possible the IUE aperture (10" X 20"). The galaxies are separated into 6 groups with similar characteristics, namely, Ellipticals, Spirals, LINER's, Seyfert 2's, Starbursts of Low and High reddening, for which we create average spectral energy distributions (SED). The individual groups SED's are normalized to the $\lambda$7000\AA flux and compared, looking for similarities and differences among them.The bolometric fluxes of different types of galaxies were calculated integrating their SED's. These values are compared with individual waveband flux densities, in order to determine the wavebands which contribute most to the bolometric flux. Linear regressions were performed between the bolometric and individual band fluxes for each kind of galaxy. These fits can be used in the calculation of the bolometric flux for other objects of similar activity type, but with reduced waveband information. We have also collected multiwavelength data for 4 HII regions, a thermal supernova remnant, and a non-thermal supernova remnant (SNR), which are compared with the Starburst SED's.Comment: 29 pages, 13 postscript figures and 10 tables. To appear in The Astronomical Journa

Static and dynamic structure factors in the Haldane phase of the bilinear-biquadratic spin-1

The excitation spectra of the T=0 dynamic structure factors for the spin, dimer, and trimer fluctuation operators as well as for the newly defined center fluctuation operator in the one-dimensional S=1 Heisenberg model wi th isotropic bilinear $(J\cos\theta)$ and biquadratic $(J\sin\theta)$ exchange are investigated via the recursion method for systems with up to N=18 site s over the predicted range, $-\pi/4<\theta\lesssim\pi/4$, of the topologically ordered Haldane phase. The four static and dynamic structure factors probe t he ordering tendencies in the various coupling regimes and the elementary and composite excitations which dominate the T=0 dynamics. At $\theta = \arctan{1/3}$ (VBS point), the dynamically relevant spectra in the invariant subspaces with total spin $S_T = 0,1,2$ are dominated by a branch of magnon states $(S_T = 1)$, by continua of two-magnon scattering states $(S_T = 0,1,2)$, and by discrete branches of two-magnon bound states with positive interaction energy $(S_T = 0,2)$. The dimer and trimer spectra at $q=\pi$ ar e found to consist of single modes with $N$-independent excitation energies $\omega_\lambda^D/|e_0|=5$ and $\omega_\lambda^T/|e_0|=6$, where $e_0=E_0/N$ is the ground-state energy per site. The basic structure of the dynamically relevant excitation spectrum remains the same over a substantial parameter range within the Haldane phase. At the transition to the dimerized phase ($\theta=-\pi/4$), the two-magnon excitations turn into two-spinon excitations.Comment: 12 pages, 4 Postscript figure