#------------------------------------------------------------------------------
#$Date: 2021-04-22 17:10:16 +0300 (Thu, 22 Apr 2021) $
#$Revision: 264415 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/24/7222459.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7222459
loop_
_publ_author_name
'Oehl, Nikolas'
'Schmuelling, Guido'
'Knipper, Martin'
'Kloepsch, Richard'
'Placke, Tobias'
'Kolny-Olesiak, Joanna'
'Plaggenborg, Thorsten'
'Winter, Martin'
'Parisi, Juergen'
_publ_section_title
;
 In situ X-ray diffraction study on the formation of α-Sn in
 nanocrystalline Sn-based electrodes for lithium-ion batteries
;
_journal_issue                   44
_journal_name_full               CrystEngComm
_journal_page_first              8500
_journal_paper_doi               10.1039/C5CE01841B
_journal_volume                  17
_journal_year                    2015
_chemical_formula_sum            Sn
_chemical_name_common            'Sn Alpha'
_space_group_IT_number           227
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_audit_creation_date             'Mon Oct 12 15:11:53 PDT 1998'
_audit_creation_method           'Maud, version 2.54'
_audit_update_record             'Last update Wed Jun 17 12:35:22 CEST 2015'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            8
_cell_length_a                   6.467(2)
_cell_length_b                   6.4665284
_cell_length_c                   6.4665284
_cell_volume                     270.42(8)
_computing_structure_refinement  'Maud, version 2.54'
_refine_ls_d_res_high            5000
_refine_ls_d_res_low             0
_refine_ls_goodness_of_fit_all   0.026165336
_refine_ls_R_factor_all          0.05188525
_refine_ls_wR_factor_all         0.07587875
_reflns_d_resolution_high        50
_reflns_d_resolution_low         0.7
_cod_data_source_file            c5ce01841b1.cif
_cod_data_source_block           Sn_Alpha
_cod_depositor_comments
;
 Changing the _symmetry_equiv_pos_site_id data item values to start from 1
 instead of 0.

 Antanas Vaitkus,
 2018-07-07

 Adding full bibliography for 7222459--7222460.cif.

 Changed the _cell_formula_units_Z data item value from '1' to '8'.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      Fd-3m:1
_cod_database_code               7222459
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loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_B_iso_or_equiv
Sn Sn 1.0 0.0 0.0 0.0 0.07743271
