TbO<sup>+</sup> in a calcium apatite matrix featuring a triple trigger-type relaxation of magnetization.
Kazin, Pavel E.; Zykin, Mikhail A.; Magdysyuk, Oxana V.; Utochnikova, Valentina V.; Gorbachev, Evgeny A.; Kremer, Reinhard K.; Schnelle, Walter; Felser, Claudia; Jansen, Martin; Dalton transactions (Cambridge, England : 2003) 48 (2019) 5299–5307; doi:10.1039/c9dt01120j

data_7049454
_publ_section_title
;
 TbO<sup>+</sup> in a calcium apatite matrix featuring a triple
 trigger-type relaxation of magnetization.
;
_journal_issue                   16
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5299
_journal_page_last               5307
_journal_paper_doi               10.1039/c9dt01120j
_journal_volume                  48
_journal_year                    2019
_chemical_formula_moiety         (Ca4.755Tb0.245)(PO4)3OH0.755-x
_chemical_formula_sum            'Ca4.755 O13 P3 Tb0.245'
_chemical_formula_weight         530.4
_chemical_name_systematic        'hydroxyapatite, Tb-doped'
_space_group_IT_number           176
_space_group_name_Hall           '-P 6c'
_space_group_name_H-M_alt        'P 63/m'
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_audit_update_record
;
2018-07-23 deposited with the CCDC.    2019-03-25 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   9.4001(1)
_cell_length_b                   9.4001(1)
_cell_length_c                   6.8744(1)
_cell_measurement_temperature    293
_cell_volume                     526.054(11)
_diffrn_ambient_temperature      293
_diffrn_detector                 'Pixium RF4343'
_diffrn_detector_type            '2D area flat panel'
_diffrn_measurement_device_type  'Diamond Light Source, I12-JEEP beamline'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.23369
_exptl_absorpt_coefficient_mu    0.589
_exptl_crystal_colour            white
_exptl_crystal_density_diffrn    3.3487
_exptl_crystal_F_000             2464
_exptl_crystal_preparation       'Magnetic properties,Luminescent'
_exptl_crystal_recrystallization_method
'high-temperature annealing in solid state'
_pd_char_colour                  white
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.01
_pd_meas_2theta_range_max        20.031
_pd_meas_2theta_range_min        0.009
_pd_meas_number_of_points        2050
_pd_proc_2theta_range_inc        0.01
_pd_proc_2theta_range_max        17.999
_pd_proc_2theta_range_min        1.006
_pd_proc_ls_background_function  '24 Chebyshev polynoms'
_pd_proc_ls_pref_orient_corr     'March & Dollase'
_pd_proc_ls_profile_function     Pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0112
_pd_proc_ls_prof_wR_expected     0.0406
_pd_proc_ls_prof_wR_factor       0.0150
_refine_diff_density_max         0.36
_refine_diff_density_min         -0.44
_refine_ls_goodness_of_fit_all   0.37
_refine_ls_number_constraints    0
_refine_ls_number_parameters     65
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0423
_refine_ls_R_factor_gt           0.0338
_refine_ls_shift/su_max          0.0269
_refine_ls_shift/su_mean         0.0026
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_all         0.0365
_refine_ls_wR_factor_gt          0.0354
_cod_data_source_file            c9dt01120j2.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:

'_diffrn_radiation_probe' value 'X-ray' changed to 'x-ray' according
to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7049454.cif.
;
_cod_original_cell_volume        526.051(12)
_cod_database_code               7049454