4-Methyl-2,6-bis(phosphonomethyl)phenol dihydrate

The 4-methyl-2,6-bis(phosphomethyl)phenol molecule, which crystallizes with two water molecules per asymmetric unit, has approximate twofold symmetry and is involved in extensive three-dimensional hydrogen bonding in which every available OH group participates. The principal dimensions include P--O 1.4981 (13) and 1.5015 (14) ,~, four P--OH distances in the range 1.5395(14) to 1.5688(13) A, P--C 1.7857(17) and 1.7893 (17) ~k, and O...O intramolecular and intermolecular hydro.gen-bond distances in the range 2.458 (2) to 2.866 (2) A

Cooling rate dependence of the antiferromagnetic domain structure of a single crystalline charge ordered manganite

The low temperature phase of single crystals of Nd$_{0.5}$Ca$_{0.5}$MnO$_3$ and Gd$_{0.5}$Ca$_{0.5}$MnO$_3$ manganites is investigated by squid magnetometry. Nd$_{0.5}$Ca$_{0.5}$MnO$_3$ undergoes a charge-ordering transition at $T_{CO}$=245K, and a long range CE-type antiferromagnetic state is established at $T_N$=145K. The dc-magnetization shows a cooling rate dependence below $T_N$, associated with a weak spontaneous moment. The associated excess magnetization is related to uncompensated spins in the CE-type antiferromagnetic structure, and to the presence in this state of fully orbital ordered regions separated by orbital domain walls. The observed cooling rate dependence is interpreted to be a consequence of the rearrangement of the orbital domain state induced by the large structural changes occurring upon cooling.Comment: REVTeX4; 7 pages, 4 figures. Revised 2001/12/0

Selective Spin-State Switch and Metal-Insulator Transition in \boldmath GdBaCo2O5.5\rm GdBaCo_2O_{5.5}

Ultra-high resolution synchrotron diffraction data for $\rm GdBaCo_2O_{5.5}$ throw new light on the metal-insulator transition of Co$^{3+}$ Ba-cobaltites. An anomalous expansion of CoO$_6$ octahedra is observed at the phase transition on heating, while CoO$_5$ pyramids show the normal shrinking at the closing of the gap. The insulator-to-metal transition is attributed to a sudden excitation of some electrons in the octahedra ($t_{2g}^6$ state) into the Co $e_g$ band (final $t_{2g}^4e_g^2$ state). The $t_{2g}^5e_g^1$ state in the pyramids does not change and the structural study also rules out a $d_{3x^2-r^2}/d_{3y^2-r^2}$ orbital ordering at $T_{MI}$.Comment: Phys. Rev. B (to appear

Spin, charge and orbital ordering in ferrimagnetic insulator YBaMn2_2O5_5

The oxygen-deficient (double) perovskite YBaMn$_2$O$_5$, containing corner-linked MnO$_5$ square pyramids, is found to exhibit ferrimagnetic ordering in its ground state. In the present work we report generalized-gradient-corrected, relativistic first-principles full-potential density-functional calculations performed on YBaMn$_2$O$_5$ in the nonmagnetic, ferromagnetic and ferrimagnetic states. The charge, orbital and spin orderings are explained with site-, angular momentum- and orbital-projected density of states, charge-density plots, electronic structure and total energy studies. YBaMn$_2$O$_5$ is found to stabilize in a G-type ferrimagnetic state in accordance with experimental results. The experimentally observed insulating behavior appears only when we include ferrimagnetic ordering in our calculation. We observed significant optical anisotropy in this material originating from the combined effect of ferrimagnetic ordering and crystal field splitting. In order to gain knowledge about the presence of different valence states for Mn in YBaMn$_2$O$_5$ we have calculated $K$-edge x-ray absorption near-edge spectra for the Mn and O atoms. The presence of the different valence states for Mn is clearly established from the x-ray absorption near-edge spectra, hyperfine field parameters and the magnetic properties study. Among the experimentally proposed structures, the recently reported description based on $P$4/$nmm$ is found to represent the stable structure

The MEGAPIE-TEST Project

The goals of the MEGAPIE initiative are to design, build and operate a 1MW heavy liquid metal target. The first step towards the realization of the MEGAPIE target was the feasibility studies, which outlined the entire project. Contextually to the feasibility studies the conceptual design phase started with the establishment of R&D working groups assisting the design and validation of both the target and its ancillary systems. In this framework the EU project MEGAPIE-TEST has been structured in three work packages with tasks concerning the finalization of the engineering design, the components and subsystem testing, the integral test and the first irradiation period. The MEGAPIE-TEST consortium is composed by the 14 partners: FZK, PSI, CEA, ENEA, SCK-CEN, CNRS /IDFE, IN2P3, LMPGM, EMN, ISMRA, UNIV-NANTES, U-PSUDXI, USTL. Currently the engineering design of the target has been finalized, its manufacturing has been launched and the design activities on the ancillary systems were almost completed. R&D activities in the fields of materials, thermal – hydraulics, structural mechanics, neutronic and nuclear assessment and liquid metal technologies were performed in order to assist specific design issues. Some Subsystem and component tests were also performed and the preparation of the integral test is an ongoing activity

Orbital ordering in the manganites: resonant x-ray scattering predictions at the manganese LII and LIII edges

It is proposed that the observation of orbital ordering in manganite materials should be possible at the L II and L III edges of manganese using x-ray resonant scattering. If performed, dipole selection rules would make the measurements much more direct than the disputed observations at the manganese K edge. They would yield specific information about the type and mechanism of the ordering not available at the K edge, as well as permitting the effects of orbital ordering and Jahn-Teller ordering to be detected and distinguished from one another. Predictions are presented based on atomic multiplet calculations, indicating distinctive dependence on energy, as well as on polarization and on the azimuthal angle around the scattering vector

Last Call for RHIC Predictions

This paper contains the individual contributions of all speakers of the session on 'Last Call for RHIC Predictions' at Quark Matter 99, and a summary by the convenor.Comment: 56 pages, psfig, epsf, epsfig, graphicx style files required, Proceedings of the XIV Int. Conf. on Nucleus-Nucleus Collisions, Quark Matter 99, Torino, Italy, May 10 - 15, 1999. Typographical mistakes corrected and figure numbers change

Measurement of the gamma gamma -> pi+ pi- and gamma gamma -> K+ K- processes at energies of 2.4 - 4.1 GeV

We have measured pi+pi- and K+K- production in two-photon collisions using 87.7 /fb of data collected with the Belle detector at the asymmetric energy e+e- collider KEKB. The cross sections are measured to high precision in the two-photon center-of-mass energy (W) range between 2.4 GeV < W < 4.1 GeV and angular region |cos theta^{*}| < 0.6. The cross section ratio sigma(gammagamma->K+K-)/sigma(gammagamma->pi+pi-) is measured to be 0.89 +- 0.04(stat) +- 0.15(syst) in the range of 3.0 GeV < W < 4.1 GeV, where the ratio is energy independent. We observe a sin^{-4} theta^{*} behavior of the cross section in the same W range. Production of chi_{c0} and chi_{c2} mesons is observed in both gammagamma -> pi+pi- and gammagamma -> K+K- modes.Comment: 17 pages, 5 figures, submitted to Phys. Lett. B, errors relative to the two-photon decay width correcte

Large enhancement of deuteron polarization with frequency modulated microwaves

We report a large enhancement of 1.7 in deuteron polarization up to values of 0.6 due to frequency modulation of the polarizing microwaves in a two liters polarized target using the method of dynamic nuclear polarization. This target was used during a deep inelastic polarized muon-deuteron scattering experiment at CERN. Measurements of the electron paramagnetic resonance absorption spectra show that frequency modulation gives rise to additional microwave absorption in the spectral wings. Although these results are not understood theoretically, they may provide a useful testing ground for the deeper understanding of dynamic nuclear polarization.Comment: 10 pages, including the figures coming in uuencoded compressed tar files in poltar.uu, which also brings cernart.sty and crna12.sty files neede