LMucko/crystallography-open-database huggingface dataset:
High-temperature powder synchrotron diffraction studies of synthetic cryolite Na3AlF6 Locality: synthetic Sample: T = 600 C, disordered model
Zhou, Q.; Kennedy, B. J.; Journal of Solid State Chemistry 177 (2004) 654–659; doi:10.1016/j.jssc.2003.08.012

data_9012286
_publ_section_title
;High-temperature powder synchrotron diffraction studies of synthetic cryolite
 Na3AlF6 Locality: synthetic Sample: T = 600 C, disordered model
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              654
_journal_page_last               659
_journal_paper_doi               10.1016/j.jssc.2003.08.012
_journal_volume                  177
_journal_year                    2004
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al F6 Na3'
_chemical_name_mineral           Cryolite
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.935
_cell_length_b                   7.935
_cell_length_c                   7.935
_cell_formula_units_Z            4
_cell_volume                     499.621
_database_code_amcsd             0014040
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    2.791
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na3 Al F6'
_cod_database_code               9012286
The crystal structure of Pb3O4
Gross, S. T.; Journal of the American Chemical Society 65 (1943) 1107–1110; doi:10.1021/ja01246a029

data_9012287
_publ_section_title
;
 The crystal structure of Pb3O4
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1107
_journal_page_last               1110
_journal_paper_doi               10.1021/ja01246a029
_journal_volume                  65
_journal_year                    1943
_chemical_compound_source        Synthetic
_chemical_formula_sum            'O4 Pb3'
_chemical_name_mineral           Minium
_space_group_IT_number           117
_symmetry_space_group_name_Hall  'P -4 -2ab'
_symmetry_space_group_name_H-M   'P -4 b 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.86
_cell_length_b                   8.86
_cell_length_c                   6.66
_cell_formula_units_Z            4
_cell_volume                     522.807
_database_code_amcsd             0014078
_exptl_crystal_density_diffrn    8.710
_cod_original_formula_sum        'Pb3 O4'
_cod_database_code               9012287
On the structure of elementary boron
Hoard, J. L.; Geller, S.; Hughes, R. E.; Journal of the American Chemical Society 73 (1951) 1892–1893; doi:10.1021/ja01148a555

data_9012288
_publ_section_title
;
 On the structure of elementary boron
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              1892
_journal_page_last               1893
_journal_paper_doi               10.1021/ja01148a555
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        Synthetic
_chemical_formula_sum            B
_chemical_name_common            Boron
_chemical_name_mineral           Boron
_space_group_IT_number           118
_symmetry_space_group_name_Hall  'P -4 -2n'
_symmetry_space_group_name_H-M   'P -4 n 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.73
_cell_length_b                   8.73
_cell_length_c                   5.03
_cell_formula_units_Z            52
_cell_volume                     383.351
_database_code_amcsd             0014080
_exptl_crystal_density_diffrn    2.435
_cod_database_code               9012288
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: Diamond #1, lattice parameter is average of three runs
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012289
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 10 C Note: Diamond #1, lattice parameter is average of three
 runs
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56669
_cell_length_b                   3.56669
_cell_length_c                   3.56669
_cell_formula_units_Z            8
_cell_volume                     45.373
_database_code_amcsd             0014081
_diffrn_ambient_temperature      283.15
_exptl_crystal_density_diffrn    3.517
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012289
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: Diamond #1, lattice parameter is average of three runs
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012290
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 20 C Note: Diamond #1, lattice parameter is average of three
 runs
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56672
_cell_length_b                   3.56672
_cell_length_c                   3.56672
_cell_formula_units_Z            8
_cell_volume                     45.374
_database_code_amcsd             0014082
_diffrn_ambient_temperature      293.15
_exptl_crystal_density_diffrn    3.517
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012290
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: Diamond #1, lattice parameter is average of three runs
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012291
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 30 C Note: Diamond #1, lattice parameter is average of three
 runs
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56678
_cell_length_b                   3.56678
_cell_length_c                   3.56678
_cell_volume                     45.376
_cell_formula_units_Z            8
_diffrn_ambient_temperature      303.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012291
_database_code_amcsd 0014083
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: Diamond #1, lattice parameter is average of three runs
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012292
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 40 C Note: Diamond #1, lattice parameter is average of three
 runs
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56684
_cell_length_b                   3.56684
_cell_length_c                   3.56684
_cell_formula_units_Z            8
_cell_volume                     45.379
_database_code_amcsd             0014084
_diffrn_ambient_temperature      313.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012292
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: Diamond #1, lattice parameter is average of three runs
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012293
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 50 C Note: Diamond #1, lattice parameter is average of three
 runs
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56690
_cell_length_b                   3.56690
_cell_length_c                   3.56690
_cell_volume                     45.381
_cell_formula_units_Z            8
_diffrn_ambient_temperature      323.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012293
_database_code_amcsd 0014085
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: white boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012294
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 10 C Note: white boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56670
_cell_length_b                   3.56670
_cell_length_c                   3.56670
_cell_volume                     45.373
_diffrn_ambient_temperature      283.15
_cell_formula_units_Z            8
_exptl_crystal_density_diffrn    3.517
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012294
_database_code_amcsd 0014086
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: white boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012295
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 20 C Note: white boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56674
_cell_length_b                   3.56674
_cell_length_c                   3.56674
_cell_volume                     45.375
_cell_formula_units_Z            8
_database_code_amcsd             0014087
_diffrn_ambient_temperature      293.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012295
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: white boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012296
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 30 C Note: white boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56675
_cell_length_b                   3.56675
_cell_length_c                   3.56675
_cell_volume                     45.375
_cell_formula_units_Z            8
_database_code_amcsd             0014088
_diffrn_ambient_temperature      303.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012296
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: white boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012297
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 40 C Note: white boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56683
_cell_length_b                   3.56683
_cell_length_c                   3.56683
_cell_volume                     45.378
_diffrn_ambient_temperature      313.15
_cell_formula_units_Z            8
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012297
_database_code_amcsd 0014089
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: white boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012298
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 50 C Note: white boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56689
_cell_length_b                   3.56689
_cell_length_c                   3.56689
_cell_volume                     45.380
_cell_formula_units_Z            8
_database_code_amcsd             0014090
_diffrn_ambient_temperature      323.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012298
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: grey boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012299
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 10 C Note: grey boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56680
_cell_length_b                   3.56680
_cell_length_c                   3.56680
_cell_volume                     45.377
_cell_formula_units_Z            8
_database_code_amcsd             0014091
_diffrn_ambient_temperature      283.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012299
Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: grey boart
Straumanis, M. E.; Aka, E. Z.; Journal of the American Chemical Society 73 (1951) 5643–5646; doi:10.1021/ja01156a043

data_9012300
_publ_section_title
;Precision determination of lattice parameter, coefficient of thermal
 expansion and atomic weight of carbon in diamond Locality: Belgian Congo
 Sample: at T = 20 C Note: grey boart
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5643
_journal_page_last               5646
_journal_paper_doi               10.1021/ja01156a043
_journal_volume                  73
_journal_year                    1951
_chemical_compound_source        'Belgian Congo'
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56680
_cell_length_b                   3.56680
_cell_length_c                   3.56680
_cell_volume                     45.377
_cell_formula_units_Z            8
_database_code_amcsd             0014092
_diffrn_ambient_temperature      293.15
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9012300