LMucko/crystallography-open-database huggingface dataset:
Thermal expansion data: II. Binary oxides with the fluorite and rutile structure, M O2, and the antifluorite structure M2 O
Taylor, D.; British Ceramic Transactions and Journal 83 (1984) 32–37; doi:

data_1514087
_publ_section_title
;
 Thermal expansion data: II. Binary oxides with the fluorite and rutile
 structure, M O2, and the antifluorite structure M2 O
;
_journal_coden_ASTM              BCTJEH
_journal_name_full               'British Ceramic Transactions and Journal'
_journal_page_first              32
_journal_page_last               37
_journal_volume                  83
_journal_year                    1984
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2005/04/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.623
_cell_length_b                   4.623
_cell_length_c                   4.623
_cell_volume                     98.803
_cod_data_source_file            'data_Li2Omelanie057411.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395927996.26-D290F29E9218B844.cif
_cod_original_cell_volume        98.8
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514087
Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums, Natriums und Kaliums
Masaki, N.; Doi, K.; Nasu, S.; Tanifuji, T.; Uchida, K.; Journal of Nuclear Materials 84 (1979) 341–342; doi:10.1016/0022-3115(79)90174-0

data_1514088
_publ_section_title
;
 Gitterstruktur der Oxide, Sulfide, Selenide und Telluride des Lithiums,
 Natriums und Kaliums
;
_journal_coden_ASTM              JNUMAM
_journal_name_full               'Journal of Nuclear Materials'
_journal_page_first              341
_journal_page_last               342
_journal_paper_doi               10.1016/0022-3115(79)90174-0
_journal_volume                  84
_journal_year                    1979
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           166
_symmetry_Int_Tables_number      166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_audit_creation_date             2007/04/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                120.
_cell_formula_units_Z            3
_cell_length_a                   3.624
_cell_length_b                   3.624
_cell_length_c                   7.97
_cell_volume                     90.649
_cod_data_source_file            'data_Li2Omelanie108886.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928152.08-D290F29E9218B844.cif
_cod_original_cell_volume        90.65
_cod_original_sg_symbol_H-M      'R -3 m H'
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514088
A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction
David, William I. F.; Jones, Martin O.; Gregory, Duncan H.; Jewell, Catherine M.; Johnson, Simon R.; Walton, Allan; Edwards, Peter P.; Journal of the American Chemical Society 129 (2007) 1594–1601; doi:10.1021/ja066016s

data_4121514
_publ_section_title
;
 A mechanism for non-stoichiometry in the lithium amide/lithium imide
 hydrogen storage reaction
;
_journal_coden_ASTM              JACSAT
_journal_issue                   6
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1594
_journal_page_last               1601
_journal_paper_doi               10.1021/ja066016s
_journal_volume                  129
_journal_year                    2007
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Lithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2008/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.614(1)
_cell_length_b                   4.614(1)
_cell_length_c                   4.614(1)
_cell_volume                     98.23(4)
_refine_ls_R_factor_all          0.0766
_cod_data_source_file            'data_Li2Omelanie173180.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928301.59-D290F29E9218B844.cif
_cod_original_cell_volume        98.23
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               4121514
A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction
David, W. I. F.; Jones, M. O.; Gregory, D. H.; Jewell, C. M.; Johnson, S. R.; Walton, A.; Edwards, P. P.; Journal of the American Chemical Society 129 (2007) 1594–1601; doi:10.1021/ja066016s

data_4121515
_publ_section_title
;
 A mechanism for non-stoichiometry in the lithium amide/lithium imide
 hydrogen storage reaction
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1594
_journal_page_last               1601
_journal_paper_doi               10.1021/ja066016s
_journal_volume                  129
_journal_year                    2007
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Lithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2008/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.6124(1)
_cell_length_b                   4.6124(1)
_cell_length_c                   4.6124(1)
_cell_volume                     98.125(4)
_refine_ls_R_factor_all          0.0724
_cod_data_source_file            'data_Li2Omelanie173193.cif'
_cod_data_source_block           173193-ICSD
_cod_original_cell_volume        98.12
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               4121515
Structure, mechanical stability and chemical bond in alkali metal oxides
Zhuravlev, Yu. N.; Obolonskaya, O. S.; Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii) 51 (2010) 1005–1013; doi:10.1007/s10947-010-0157-1

data_1514089
_publ_section_title
;
 Structure, mechanical stability and chemical bond in alkali metal oxides
;
_journal_coden_ASTM              JSTCAM
_journal_issue                   6
_journal_name_full
'Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)'
_journal_page_first              1005
_journal_page_last               1013
_journal_paper_doi               10.1007/s10947-010-0157-1
_journal_volume                  51
_journal_year                    2010
_chemical_formula_structural     'Li2 O2'
_chemical_formula_sum            'Li2 O2'
_chemical_name_systematic        'Dilithium Peroxide'
_space_group_IT_number           194
_symmetry_Int_Tables_number      194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_audit_creation_date             2011/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                120.
_cell_formula_units_Z            2
_cell_length_a                   3.164
_cell_length_b                   3.164
_cell_length_c                   7.724
_cell_volume                     66.965
_cod_data_source_file            'data_Li2O2melanie180557.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928569.22-D290F29E9218B844.cif
_cod_original_cell_volume        66.96
_cod_database_code               1514089
Structure, mechanical stability and chemical bond in alkali metal oxides
Zhuravlev, Yu. N.; Obolonskaya, O. S.; Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii) 51 (2010) 1005–1013; doi:10.1007/s10947-010-0157-1

data_1514090
_publ_section_title
;
 Structure, mechanical stability and chemical bond in alkali metal oxides
;
_journal_coden_ASTM              JSTCAM
_journal_issue                   6
_journal_name_full
;
 Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)
;
_journal_page_first              1005
_journal_page_last               1013
_journal_paper_doi               10.1007/s10947-010-0157-1
_journal_volume                  51
_journal_year                    2010
_chemical_formula_structural     'Li O2'
_chemical_formula_sum            'Li O2'
_chemical_name_systematic        'Lithium Peroxide - Ii'
_space_group_IT_number           58
_symmetry_Int_Tables_number      58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_audit_creation_date             2011/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   3.992
_cell_length_b                   4.877
_cell_length_c                   2.961
_cell_volume                     57.648
_cod_data_source_file            'data_LiO2melanie180561.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928670.99-D290F29E9218B844.cif
_cod_original_cell_volume        57.65
_cod_original_formula_sum        'Li1 O2'
_cod_database_code               1514090
Structure, mechanical stability and chemical bond in alkali metal oxides
Zhuravlev, Yu. N.; Obolonskaya, O. S.; Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii) 51 (2010) 1005–1013; doi:10.1007/s10947-010-0157-1

data_1514091
_publ_section_title
;
 Structure, mechanical stability and chemical bond in alkali metal oxides
;
_journal_coden_ASTM              JSTCAM
_journal_issue                   6
_journal_name_full
;
 Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)
;
_journal_page_first              1005
_journal_page_last               1013
_journal_paper_doi               10.1007/s10947-010-0157-1
_journal_volume                  51
_journal_year                    2010
_chemical_formula_structural     'Li O3'
_chemical_formula_sum            'Li O3'
_chemical_name_systematic        'Lithium Ozonide - Hypothetical'
_space_group_IT_number           44
_symmetry_Int_Tables_number      44
_symmetry_space_group_name_Hall  'I 2 -2'
_symmetry_space_group_name_H-M   'I m m 2'
_audit_creation_date             2011/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   3.053
_cell_length_b                   4.931
_cell_length_c                   5.197
_cell_volume                     78.237
_cod_data_source_file            'data_LiO3melanie180565.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928780.65-D290F29E9218B844.cif
_cod_original_cell_volume        78.24
_cod_original_formula_sum        'Li1 O3'
_cod_database_code               1514091
Structure, mechanical stability and chemical bond in alkali metal oxides
Zhuravlev, Yu. N.; Obolonskaya, O. S.; Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii) 51 (2010) 1005–1013; doi:10.1007/s10947-010-0157-1

data_1514092
_publ_section_title
;
 Structure, mechanical stability and chemical bond in alkali metal oxides
;
_journal_coden_ASTM              JSTCAM
_journal_issue                   6
_journal_name_full
;
 Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)
;
_journal_page_first              1005
_journal_page_last               1013
_journal_paper_doi               10.1007/s10947-010-0157-1
_journal_volume                  51
_journal_year                    2010
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2011/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.620
_cell_length_b                   4.620
_cell_length_c                   4.620
_cell_volume                     98.611
_cod_data_source_file            'data_Li2Omelanie180569.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395928921.21-D290F29E9218B844.cif
_cod_depositor_comments
;
 Reordered symmetry operations to have 'x,y,z' as the first operation.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_cell_volume        98.61
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514092
Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514093
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2 O using
 neutron diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2012/02/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.728(5)
_cell_length_b                   4.728(5)
_cell_length_c                   4.728(5)
_cell_volume                     105.69(19)
_refine_ls_R_factor_all          0.0431
_cod_data_source_file            'data_Li2Omelanie182024.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929021.27-D290F29E9218B844.cif
_cod_original_cell_volume        105.69
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514093
Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514094
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2 O using
 neutron diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2012/02/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.764(5)
_cell_length_b                   4.764(5)
_cell_length_c                   4.764(5)
_cell_volume                     108.1(2)
_refine_ls_R_factor_all          0.0514
_cod_data_source_file            'data_Li2Omelanie182025.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929090.99-D290F29E9218B844.cif
_cod_original_cell_volume        108.12
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514094
Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514095
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2 O using
 neutron diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2012/02/01
_audit_update_record             2013/08/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.782(5)
_cell_length_b                   4.782(5)
_cell_length_c                   4.782(5)
_cell_volume                     109.4(2)
_refine_ls_R_factor_all          0.0577
_cod_data_source_file            'data_Li2Omelanie182026.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929153.72-D290F29E9218B844.cif
_cod_original_cell_volume        109.35
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514095
Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514096
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2 O using
 neutron diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2012/02/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.807(5)
_cell_length_b                   4.807(5)
_cell_length_c                   4.807(5)
_cell_volume                     111.1(2)
_refine_ls_R_factor_all          0.0613
_cod_data_source_file            'data_Li2Omelanie182027.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929222.35-D290F29E9218B844.cif
_cod_original_cell_volume        111.08
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514096
Investigation of thermally induced Li+ ion disorder in Li2 O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514097
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2 O using
 neutron diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Dilithium Oxide'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2012/02/01
_cell_angle_alpha                90.
_cell_angle_beta                 90.
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   4.837(5)
_cell_length_b                   4.837(5)
_cell_length_c                   4.837(5)
_cell_volume                     113.2(2)
_refine_ls_R_factor_all          0.069
_cod_data_source_file            'data_Li2Omelanie182028.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929301.37-D290F29E9218B844.cif
_cod_original_cell_volume        113.17
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514097
Investigation of thermally induced Li+ ion disorder in Li2O using neutron diffraction.
Farley, T. W. D.; Hayes, W.; Hull, S.; Hutchings, M. T.; Vrtis, M.; Journal of Physics: Condensed Matter 3 (1991) 4761–4781; doi:10.1088/0953-8984/3/26/001

data_1514098
_publ_section_title
;
 Investigation of thermally induced Li+ ion disorder in Li2O using neutron
 diffraction.
;
_journal_coden_ASTM              JCOMEL
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              4761
_journal_page_last               4781
_journal_paper_doi               10.1088/0953-8984/3/26/001
_journal_volume                  3
_journal_year                    1991
_chemical_formula_structural     'Li2 O'
_chemical_formula_sum            'Li2 O'
_chemical_name_systematic        'Lithium Oxide (2/1)'
_space_group_IT_number           225
_symmetry_Int_Tables_number      225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_audit_creation_date             2008/07/07
_audit_update_record             2013/02/01
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   4.689(5)
_cell_length_b                   4.689(5)
_cell_length_c                   4.689(5)
_cell_volume                     103.10(19)
_refine_ls_R_factor_all          0.038
_cod_data_source_file            'data_Li2Omelanie642216.cif'
_cod_data_source_block
/var/www/cod/tmp/uploads/1395929360.9-D290F29E9218B844.cif
_cod_original_cell_volume        103.1
_cod_original_formula_sum        'Li2 O1'
_cod_database_code               1514098