Preparation and Crystal Structures of Bismuth Technetates: A New Metal Oxide System
Efrain E. Rodriguez; Frédéric Poineau; Anna Llobet; Ken Czerwinski; Ram Seshadri; Anthony K. Cheetham; Inorganic Chemistry 47 (2008) 6281–6288; doi:10.1021/ic8003273

data_4305345
_publ_contact_author_address
;Dempartment of Materials Science and Metallurgy
University of Cambridge
Pembroke Street
Cambridge, CB2 3QZ, UK
;
_publ_contact_author_email       akc30@cam.ac.uk
_publ_contact_author_fax         '01223 334567'
_publ_contact_author_name        'Anthony K. Cheetham'
_publ_contact_author_phone       '01223 767061'
_publ_section_title
;
Preparation and Crystal Structures of Bismuth Technetates: A New Metal
Oxide System
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6281
_journal_page_last               6288
_journal_paper_doi               10.1021/ic8003273
_journal_volume                  47
_journal_year                    2008
_chemical_formula_structural     'Bi2 Tc2 O6.86'
_chemical_formula_sum            'Bi2 O6.86 Tc2'
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_chemical_name_common            'Bismuth technetate'
_chemical_name_systematic        'Bismuth technetium oxide (2/2/6.86)'
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_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_audit_author_name               'Efrain E. Rodriguez'
_audit_creation_date             2008-02-13T17:08
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_audit_update_record
' 2008-02-13T17:08  Initial CIF as created by GSAS2CIF'
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_cell_length_a                   10.47458(10)
_cell_length_b                   10.47458
_cell_length_c                   10.47458
_cell_measurement_temperature    295
_cell_volume                     1149.238(11)
_computing_structure_refinement  GSAS
_exptl_crystal_density_diffrn    8.389
_pd_block_id
2008-02-13T17:08|BI2TC2O7_12-21-06_phase1|Efrain_E._Rodriguez||
_pd_phase_name                   'Bi2Tc2O7 structure'
_refine_ls_goodness_of_fit_all   2.05
_refine_ls_matrix_type           full
_refine_ls_number_parameters     15
_refine_ls_number_restraints     0
_refine_ls_shift/su_max          0.03
_refine_ls_shift/su_mean         0.01
_cod_data_source_file            ic8003273-file003_1.cif
_cod_data_source_block           Bi2Tc2O7_npd
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_angle_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (17
times).

'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (21 time).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        1149.237(33)
_cod_original_sg_symbol_H-M      'F d -3 m'
_cod_database_code               4305345