#------------------------------------------------------------------------------ #$Date: 2016-02-19 14:29:56 +0000 (Fri, 19 Feb 2016) $ #$Revision: 176759 $ #$URL: svn://www.crystallography.net/cod/cif/2/00/34/2003493.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2003493 loop_ _publ_author_name 'Kennedy, B. J.' _publ_section_title ; Structure Refinement of Y~2~Ru~2~O~7~ by Neutron Powder Diffraction ; _journal_issue 5 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 790 _journal_page_last 792 _journal_paper_doi 10.1107/S0108270194013168 _journal_volume 51 _journal_year 1995 _chemical_compound_source Powder _chemical_formula_moiety 'Y2 Ru2 O7' _chemical_formula_sum 'O7 Ru2 Y2' _chemical_formula_weight 491.95 _symmetry_cell_setting cubic _symmetry_space_group_name_Hall 'F 4d 2 3 -1d' _symmetry_space_group_name_H-M 'F d 3 m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 10.1429(2) _cell_length_b 10.1429(2) _cell_length_c 10.1429(2) _cell_measurement_reflns_used 868 _cell_measurement_temperature 295 _cell_volume 1043.49(4) _diffrn_measurement_device 'Polaris tof neutron' _diffrn_radiation_probe neutron _diffrn_radiation_type neutron _diffrn_radiation_wavelength time-of-flight _exptl_crystal_colour Black _exptl_crystal_density_diffrn 6.26 _refine_ls_number_parameters 31 _refine_ls_number_reflns 868 _refine_ls_R_factor_obs 0.0602 _refine_ls_wR_factor_obs 0.0794 _cod_data_source_file oh1070.cif _cod_data_source_block oh1070a _cod_original_cell_volume 1043.48 _cod_database_code 2003493 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Y .5 .5 .5 ? Ru .0 .0 .0 ? O1 .33536(3) .125 .125 ? O2 .375 .375 .375 ?