LMucko/crystallography-open-database huggingface dataset:
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 12 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011984
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 12 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   5.159
_cell_length_b                   5.159
_cell_length_c                   5.159
_cell_formula_units_Z            4
_cell_volume                     137.308
_database_code_amcsd             0013228
_diffrn_ambient_pressure         1.2e+07
_exptl_crystal_density_diffrn    1.891
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011984
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 12.4 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011985
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 12.4 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   5.148
_cell_length_b                   5.148
_cell_length_c                   5.148
_cell_formula_units_Z            4
_cell_volume                     136.432
_database_code_amcsd             0013229
_diffrn_ambient_pressure         1.24e+07
_exptl_crystal_density_diffrn    1.903
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011985
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 13.8 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011986
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 13.8 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   5.104
_cell_length_b                   5.104
_cell_length_c                   5.104
_cell_formula_units_Z            4
_cell_volume                     132.963
_database_code_amcsd             0013230
_diffrn_ambient_pressure         1.38e+07
_exptl_crystal_density_diffrn    1.953
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011986
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 14.3 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011987
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 14.3 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   5.048
_cell_length_b                   5.048
_cell_length_c                   5.048
_cell_formula_units_Z            4
_cell_volume                     128.635
_database_code_amcsd             0013231
_diffrn_ambient_pressure         1.43e+07
_exptl_crystal_density_diffrn    2.019
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011987
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 15 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011988
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 15 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   5.025
_cell_length_b                   5.025
_cell_length_c                   5.025
_cell_formula_units_Z            4
_cell_volume                     126.884
_database_code_amcsd             0013232
_diffrn_ambient_pressure         1.5e+07
_exptl_crystal_density_diffrn    2.047
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011988
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 16.5 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011989
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 16.5 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   4.963
_cell_length_b                   4.963
_cell_length_c                   4.963
_cell_formula_units_Z            4
_cell_volume                     122.245
_database_code_amcsd             0013233
_diffrn_ambient_pressure         1.65e+07
_exptl_crystal_density_diffrn    2.124
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011989
Compression and polymorphism of potassium to 400 Kbar Sample: fcc at P = 16.8 GPa
Liu, L.; Journal of Physics and Chemistry of Solids 47 (1986) 1067–1072; doi:10.1016/0022-3697(86)90073-9

data_9011990
_publ_section_title
;
 Compression and polymorphism of potassium to 400 Kbar
 Sample: fcc at P = 16.8 GPa
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1067
_journal_page_last               1072
_journal_paper_doi               10.1016/0022-3697(86)90073-9
_journal_volume                  47
_journal_year                    1986
_chemical_compound_source        Synthetic
_chemical_formula_sum            K
_chemical_name_common            Potassium
_chemical_name_mineral           Potassium
_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                   4.973
_cell_length_b                   4.973
_cell_length_c                   4.973
_cell_formula_units_Z            4
_cell_volume                     122.986
_database_code_amcsd             0013234
_diffrn_ambient_pressure         1.68e+07
_exptl_crystal_density_diffrn    2.112
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9011990
Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium I. Chain structures
Welz, D.; Deppe, P.; Schaefer, W.; Sabrowsky, H.; Rosenberg, M.; Journal of Physics and Chemistry of Solids 50 (1989) 297–308; doi:10.1016/0022-3697(89)90492-7

data_9011991
_publ_section_title
;
 Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium
 I. Chain structures
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              297
_journal_page_last               308
_journal_paper_doi               10.1016/0022-3697(89)90492-7
_journal_volume                  50
_journal_year                    1989
_chemical_formula_structural     Tl3Fe2S4
_chemical_formula_sum            'Fe2 S4 Tl3'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.38
_cell_length_b                   10.73
_cell_length_c                   11.14
_cell_formula_units_Z            4
_cell_volume                     882.148
_database_code_amcsd             0013235
_exptl_crystal_density_diffrn    6.423
_cod_original_formula_sum        'Tl3 Fe2 S4'
_cod_database_code               9011991
_amcsd_formula_title             Tl3Fe2S4
Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium I. Chain structures
Welz, D.; Deppe, P.; Schaefer, W.; Sabrowsky, H.; Rosenberg, M.; Journal of Physics and Chemistry of Solids 50 (1989) 297–308; doi:10.1016/0022-3697(89)90492-7

data_9011992
_publ_section_title
;
 Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium
 I. Chain structures
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              297
_journal_page_last               308
_journal_paper_doi               10.1016/0022-3697(89)90492-7
_journal_volume                  50
_journal_year                    1989
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Fe S2 Tl'
_chemical_name_mineral           Raguinite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 144.60
_cell_angle_gamma                90
_cell_length_a                   11.68
_cell_length_b                   5.32
_cell_length_c                   10.53
_cell_formula_units_Z            4
_cell_volume                     379.029
_database_code_amcsd             0013236
_exptl_crystal_density_diffrn    5.684
_cod_original_formula_sum        'Tl Fe S2'
_cod_database_code               9011992
Third-generation synchrotron X-ray diffraction of 6-mue-m crystal of raite, ~Na3Mn3Ti0.25Si8O20(OH)2*10(H2O) opens up new chemistry and physics of low-temperature minerals Kola Peninsula, Russia
Pluth, J. J.; Smith, J. V.; Pushcharovsky, D. Y.; Semenov, E. I.; Bram, A.; Riekel, C.; Weber, H. P.; Broach, R. W.; Proceedings of the National Academy of Sciences of the United States of America 94 (1997) 12263–12267; doi:10.1073/pnas.94.23.12263

data_9011993
_publ_section_title
;
 Third-generation synchrotron X-ray diffraction of 6-mue-m crystal of raite,
 ~Na3Mn3Ti0.25Si8O20(OH)2*10(H2O) opens up new chemistry and physics of
 low-temperature minerals
 Kola Peninsula, Russia
;
_journal_name_full
;Proceedings of the National Academy of Sciences of the United States of
 America
;
_journal_page_first              12263
_journal_page_last               12267
_journal_paper_doi               10.1073/pnas.94.23.12263
_journal_volume                  94
_journal_year                    1997
_chemical_compound_source
'Yubileinaya pegmatite, Karnasurt Mountain, Lovozero massif,'
_chemical_formula_sum            'H22 Mn3 Na3 O32 Si8 Ti0.226'
_chemical_name_mineral           Raite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 100.5
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   15.1
_cell_length_b                   17.6
_cell_length_c                   5.290
_cell_volume                     1382.329
_database_code_amcsd             0015330
_exptl_crystal_density_diffrn    2.411
_cod_original_formula_sum        'Na3 Mn3 Ti.226 Si8 O32 H22'
_cod_database_code               9011993
The crystal structure of arsenic at 4.2, 78 and 299 K Sample: T = 4.2 K
Schiferl, D.; Barrett, C. S.; Journal of Applied Crystallography 2 (1969) 30–36; doi:10.1107/S0021889869006443

data_9011994
_publ_section_title
;
 The crystal structure of arsenic at 4.2, 78 and 299 K
 Sample: T = 4.2 K
;
_journal_coden_ASTM              JACGAR
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              30
_journal_page_last               36
_journal_paper_doi               10.1107/S0021889869006443
_journal_volume                  2
_journal_year                    1969
_chemical_formula_sum            Bi
_chemical_name_common            Bismuth
_chemical_name_mineral           Bismuth
_chemical_name_systematic        Bismuth
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4.5330
_cell_length_b                   4.5330
_cell_length_c                   11.797
_cell_volume                     209.930
_diffrn_ambient_temperature      4.2
_exptl_crystal_density_diffrn    4.959
_cod_duplicate_entry             9009656
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_database_code               9011994
The crystal structure of arsenic at 4.2, 78 and 299 K Sample: T = 78 K
Schiferl, D.; Barrett, C. S.; Journal of Applied Crystallography 2 (1969) 30–36; doi:10.1107/S0021889869006443

data_9011995
_publ_section_title
;
 The crystal structure of arsenic at 4.2, 78 and 299 K
 Sample: T = 78 K
;
_journal_coden_ASTM              JACGAR
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              30
_journal_page_last               36
_journal_paper_doi               10.1107/S0021889869006443
_journal_volume                  2
_journal_year                    1969
_chemical_formula_sum            Bi
_chemical_name_common            Bismuth
_chemical_name_mineral           Bismuth
_chemical_name_systematic        Bismuth
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4.5350
_cell_length_b                   4.5350
_cell_length_c                   11.814
_cell_volume                     210.418
_diffrn_ambient_temperature      78
_exptl_crystal_density_diffrn    4.948
_cod_duplicate_entry             9009657
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_database_code               9011995
The crystal structure of arsenic at 4.2, 78 and 299 K Sample: T = 298 K
Schiferl, D.; Barrett, C. S.; Journal of Applied Crystallography 2 (1969) 30–36; doi:10.1107/S0021889869006443

data_9011996
_publ_section_title
;
 The crystal structure of arsenic at 4.2, 78 and 299 K
 Sample: T = 298 K
;
_journal_coden_ASTM              JACGAR
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              30
_journal_page_last               36
_journal_paper_doi               10.1107/S0021889869006443
_journal_volume                  2
_journal_year                    1969
_chemical_formula_sum            Bi
_chemical_name_common            Bismuth
_chemical_name_mineral           Bismuth
_chemical_name_systematic        Bismuth
_space_group_IT_number           166
_space_group_name_Hall           '-R 3 2"'
_space_group_name_H-M_alt        'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   4.5460
_cell_length_b                   4.5460
_cell_length_c                   11.862
_cell_volume                     212.299
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    4.904
_cod_duplicate_entry             9009658
_cod_original_sg_symbol_H-M      'R 3 m'
_cod_database_code               9011996
Accurate lattice constants from multiple reflection mesurements II. lattice constants of germanium, silicon and diamond Sample: at T = 25 C
Hom, T.; Kiszenick, W.; Post, B.; Journal of Applied Crystallography 8 (1975) 457–458; doi:10.1107/S0021889875010965

data_9011997
_publ_section_title
;
 Accurate lattice constants from multiple reflection mesurements II.
 lattice constants of germanium, silicon and diamond
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              457
_journal_page_last               458
_journal_paper_doi               10.1107/S0021889875010965
_journal_volume                  8
_journal_year                    1975
_chemical_compound_source        unknown
_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                   3.566986
_cell_length_b                   3.566986
_cell_length_c                   3.55986
_cell_formula_units_Z            8
_cell_volume                     45.293
_database_code_amcsd             0012842
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    3.523
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9011997
Accurate lattice constants from multiple reflection mesurements II. lattice constants of germanium, silicon and diamond Sample: at T = 25 C
Hom, T.; Kiszenick, W.; Post, B.; Journal of Applied Crystallography 8 (1975) 457–458; doi:10.1107/S0021889875010965

data_9011998
_publ_section_title
;
 Accurate lattice constants from multiple reflection mesurements II.
 lattice constants of germanium, silicon and diamond
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              457
_journal_page_last               458
_journal_paper_doi               10.1107/S0021889875010965
_journal_volume                  8
_journal_year                    1975
_chemical_compound_source        Synthetic
_chemical_formula_sum            Si
_chemical_name_common            Silicon
_chemical_name_mineral           Silicon
_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                   5.430941
_cell_length_b                   5.430941
_cell_length_c                   5.430941
_cell_formula_units_Z            8
_cell_volume                     160.186
_database_code_amcsd             0012843
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    2.329
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9011998
Accurate lattice constants from multiple reflection mesurements II. lattice constants of germanium, silicon and diamond Sample: at T = 25 C
Hom, T.; Kiszenick, W.; Post, B.; Journal of Applied Crystallography 8 (1975) 457–458; doi:10.1107/S0021889875010965

data_9011999
_publ_section_title
;
 Accurate lattice constants from multiple reflection mesurements II.
 lattice constants of germanium, silicon and diamond
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              457
_journal_page_last               458
_journal_paper_doi               10.1107/S0021889875010965
_journal_volume                  8
_journal_year                    1975
_chemical_compound_source        Synthetic
_chemical_formula_sum            Ge
_chemical_name_common            Germanium
_chemical_name_mineral           Germanium
_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                   5.657820
_cell_length_b                   5.657820
_cell_length_c                   5.657820
_cell_formula_units_Z            8
_cell_volume                     181.112
_database_code_amcsd             0012844
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    5.326
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9011999
Structure refinement of an FeCl3 crystal using a thin plate sample
Hashimoto, S.; Forster, K.; Moss, S. C.; Journal of Applied Crystallography 22 (1988) 173–180; doi:10.1107/S0021889888013913

data_9012000
_publ_section_title
;
 Structure refinement of an FeCl3 crystal using a thin plate sample
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              173
_journal_page_last               180
_journal_paper_doi               10.1107/S0021889888013913
_journal_volume                  22
_journal_year                    1988
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Cl3 Fe'
_chemical_name_mineral           Molysite
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   6.0650
_cell_length_b                   6.0650
_cell_length_c                   17.420
_cell_formula_units_Z            6
_cell_volume                     554.933
_database_code_amcsd             0012857
_exptl_crystal_density_diffrn    2.912
_cod_original_sg_symbol_H-M      'R -3'
_cod_original_formula_sum        'Fe Cl3'
_cod_database_code               9012000