Crystal Growth, Structural, Electrical, and Magnetic Properties of Mixed-Valent Compounds YbOs2Al10 and LuOs2Al10.
Zhang, Xu; Yi, Wei; Feng, Kai; Wu, Desheng; Yang, Yifeng; Zheng, Ping; Yao, Jiyong; Matsushita, Yoshitaka; Sato, Akira; Jiang, Hongwei; Wang, Hai; Shi, Youguo; Yamaura, Kazunari; Wang, Nanlin; Inorganic chemistry 53 (2014) 4387–4393; doi:10.1021/ic403168v

data_4338170
_publ_section_title
;
 Crystal Growth, Structural, Electrical, and Magnetic Properties of
 Mixed-Valent Compounds YbOs2Al10 and LuOs2Al10.
;
_journal_issue                   9
_journal_name_full               'Inorganic chemistry'
_journal_page_first              4387
_journal_page_last               4393
_journal_paper_doi               10.1021/ic403168v
_journal_volume                  53
_journal_year                    2014
_chemical_formula_sum            'Al10 Os2 Yb'
_chemical_formula_weight         823.24
_space_group_IT_number           63
_space_group_name_Hall           '-C 2c 2'
_space_group_name_H-M_alt        'C m c m'
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2014-03-08 # Formatted by publCIF

;
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.1005(4)
_cell_length_b                   10.1855(4)
_cell_length_c                   9.1118(5)
_cell_measurement_reflns_used    3568
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.17
_cell_measurement_theta_min      3.01
_cell_volume                     844.60(7)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0527
_diffrn_reflns_av_sigmaI/netI    0.0373
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            3570
_diffrn_reflns_theta_full        27.93
_diffrn_reflns_theta_max         29.73
_diffrn_reflns_theta_min         3.21
_exptl_absorpt_coefficient_mu    41.956
_exptl_absorpt_correction_T_max  0.0550
_exptl_absorpt_correction_T_min  0.0076
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ' '
_exptl_crystal_colour            Metallic
_exptl_crystal_density_diffrn    6.474
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Plate
_exptl_crystal_F_000             1408
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.05
_refine_diff_density_max         2.721
_refine_diff_density_min         -2.723
_refine_diff_density_rms         0.684
_refine_ls_extinction_coef       0.0084(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.442
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     41
_refine_ls_number_reflns         563
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.442
_refine_ls_R_factor_all          0.0291
_refine_ls_R_factor_gt           0.0288
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0400P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0793
_refine_ls_wR_factor_ref         0.0795
_reflns_number_gt                559
_reflns_number_total             563
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic403168v_si_002.cif
_cod_data_source_block           final
_cod_depositor_comments
'Adding full bibliography for 4338170--4338171.cif.'
_cod_database_code               4338170