High-Pressure Synthesis, Crystal Structure, and Electromagnetic Properties of CdRh2O4: an Analogous Oxide of the Postspinel Mineral MgAl2O4
Xia Wang; Yanfeng Guo; Youguo Shi; Alexei A. Belik; Yoshihiro Tsujimoto; Wei Yi; Ying Sun; Yuichi Shirako; Masao Arai; Masaki Akaogi; Yoshitaka Matsushita; Kazunari Yamaura; Inorganic Chemistry 51 (2012) 6868–6875; doi:10.1021/ic300628m

data_4329524
_publ_section_title
;
 High-Pressure Synthesis, Crystal Structure, and Electromagnetic
 Properties of CdRh2O4: an Analogous Oxide of the Postspinel Mineral
 MgAl2O4
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6868
_journal_page_last               6875
_journal_paper_doi               10.1021/ic300628m
_journal_volume                  51
_journal_year                    2012
_chemical_formula_sum            'Cd O3.9433 Rh2'
_chemical_formula_weight         381.31
_chemical_name_systematic
;
?
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           62
_space_group_name_Hall           '-P 2ac 2n'
_space_group_name_H-M_alt        'P n m a'
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   9.12016(8)
_cell_length_b                   3.05648(3)
_cell_length_c                   10.78500(10)
_cell_measurement_temperature    295
_cell_volume                     300.638(5)
_computing_cell_refinement       'RIETAN-FP (Izumi and Momma, 2007)'
_computing_molecular_graphics    'VESTA (Momma and Izumi, 2008)'
_computing_structure_refinement  'RIETAN-FP (Izumi and Momma, 2007)'
_diffrn_ambient_temperature      295
_diffrn_measurement_device_type  'RIGAKU RINT 2500'
_diffrn_radiation_monochromator  none
_diffrn_source                   'sealed X-ray tube'
_diffrn_source_target            Cu
_exptl_crystal_density_diffrn    8.424
_exptl_crystal_F_000             678.177
_pd_calc_method                  'Rietveld Refinement'
_pd_char_colour                  black
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.02
_pd_meas_2theta_range_max        110
_pd_meas_2theta_range_min        10
_pd_meas_number_of_points        5000
_pd_meas_scan_method             step
_pd_prep_pressure                6.0e+06
_pd_prep_temperature             1695
_pd_proc_2theta_range_inc        0.02
_pd_proc_2theta_range_max        110
_pd_proc_2theta_range_min        10
_pd_proc_ls_background_function  'Legendre polynomials'
_pd_proc_ls_pref_orient_corr     ' ?'
_pd_proc_ls_profile_function     'split pseudo-Voigt function'
_pd_proc_ls_prof_R_factor        0.016
_pd_proc_ls_prof_wR_expected     0.053
_pd_proc_ls_prof_wR_factor       0.069
_pd_spec_mounting                '  powder '
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.21
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           fullcycle
_refine_ls_number_constraints    10
_refine_ls_number_parameters     116
_refine_ls_number_restraints     0
_refine_ls_shift/su_max          0.0
_refine_ls_structure_factor_coef Inet
_refine_ls_weighting_scheme      sigma
_cod_data_source_file            ic300628m_si_002_1.cif
_cod_data_source_block           Postspinel
_cod_original_cell_volume        300.6385(49)
_cod_original_formula_sum        'Cd O3.9433 Rh2  '
_cod_database_code               4329524