LMucko/crystallography-open-database huggingface dataset:
High-temperature crystallography of olivines and spinels T = 530 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013095
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 530 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.767
_cell_length_b                   10.248
_cell_length_c                   6.0059
_cell_formula_units_Z            4
_cell_volume                     293.402
_database_code_amcsd             0014395
_diffrn_ambient_temperature      803.15
_exptl_crystal_density_diffrn    3.185
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013095
High-temperature crystallography of olivines and spinels T = 700 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013096
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 700 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.777
_cell_length_b                   10.269
_cell_length_c                   6.0184
_cell_formula_units_Z            4
_cell_volume                     295.233
_database_code_amcsd             0014396
_diffrn_ambient_temperature      973.15
_exptl_crystal_density_diffrn    3.165
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013096
High-temperature crystallography of olivines and spinels T = 950 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013097
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 950 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.789
_cell_length_b                   10.321
_cell_length_c                   6.045
_cell_formula_units_Z            4
_cell_volume                     298.788
_database_code_amcsd             0014397
_diffrn_ambient_temperature      1223.15
_exptl_crystal_density_diffrn    3.128
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013097
High-temperature crystallography of olivines and spinels T = 1050 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013098
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 1050 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.7951
_cell_length_b                   10.343
_cell_length_c                   6.0571
_cell_formula_units_Z            4
_cell_volume                     300.406
_database_code_amcsd             0014398
_diffrn_ambient_temperature      1323.15
_exptl_crystal_density_diffrn    3.111
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013098
High-temperature crystallography of olivines and spinels T = 1210 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013099
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 1210 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.808
_cell_length_b                   10.378
_cell_length_c                   6.077
_cell_formula_units_Z            4
_cell_volume                     303.227
_database_code_amcsd             0014399
_diffrn_ambient_temperature      1483.15
_exptl_crystal_density_diffrn    3.082
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013099
High-temperature crystallography of olivines and spinels T = 1400 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013100
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 1400 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.819
_cell_length_b                   10.424
_cell_length_c                   6.099
_cell_formula_units_Z            4
_cell_volume                     306.373
_database_code_amcsd             0014400
_diffrn_ambient_temperature      1673.15
_exptl_crystal_density_diffrn    3.050
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013100
High-temperature crystallography of olivines and spinels T = 1600 degree C
Takeuchi, Y.; Yamanaka, T.; Haga, N.; Hirano, M.; Materials Science of the Earth's Interior, edited by Sunagawa 1984 (1984) 191–231; doi:

data_9013101
_publ_section_title
;
 High-temperature crystallography of olivines and spinels
 T = 1600 degree C
;
_journal_name_full
'Materials Science of the Earth's Interior, edited by Sunagawa'
_journal_page_first              191
_journal_page_last               231
_journal_volume                  1984
_journal_year                    1984
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.834
_cell_length_b                   10.455
_cell_length_c                   6.1147
_cell_formula_units_Z            4
_cell_volume                     309.034
_database_code_amcsd             0014401
_diffrn_ambient_temperature      1873.15
_exptl_crystal_density_diffrn    3.024
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9013101
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 25 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013102
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 25 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4304
_cell_length_b                   5.4304
_cell_length_c                   5.4304
_cell_formula_units_Z            8
_cell_volume                     160.138
_database_code_amcsd             0015103
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    2.330
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013102
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 345 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013103
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 345 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4370
_cell_length_b                   5.4370
_cell_length_c                   5.4370
_cell_formula_units_Z            8
_cell_volume                     160.723
_database_code_amcsd             0015104
_diffrn_ambient_temperature      618.15
_exptl_crystal_density_diffrn    2.321
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013103
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 525 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013104
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 525 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4410
_cell_length_b                   5.4410
_cell_length_c                   5.4410
_cell_formula_units_Z            8
_cell_volume                     161.078
_database_code_amcsd             0015105
_diffrn_ambient_temperature      798.15
_exptl_crystal_density_diffrn    2.316
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013104
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 615 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013105
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 615 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4432
_cell_length_b                   5.4432
_cell_length_c                   5.4432
_cell_formula_units_Z            8
_cell_volume                     161.273
_database_code_amcsd             0015106
_diffrn_ambient_temperature      888.15
_exptl_crystal_density_diffrn    2.313
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013105
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 700 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013106
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 700 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4455
_cell_length_b                   5.4455
_cell_length_c                   5.4455
_cell_formula_units_Z            8
_cell_volume                     161.478
_database_code_amcsd             0015107
_diffrn_ambient_temperature      973.15
_exptl_crystal_density_diffrn    2.311
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013106
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 785 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013107
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 785 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4480
_cell_length_b                   5.4480
_cell_length_c                   5.4480
_cell_formula_units_Z            8
_cell_volume                     161.700
_database_code_amcsd             0015108
_diffrn_ambient_temperature      1058.15
_exptl_crystal_density_diffrn    2.307
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013107
Lattice constants and thermal expansion of silicon up to 900 C by X-ray method Locality: synthetic Sample: at T = 878 C
Dutta, B. N.; Physica Status Solidi 2 (1962) 984–987; doi:10.1002/pssb.19620020803

data_9013108
_publ_section_title
;Lattice constants and thermal expansion of silicon up to 900 C by X-ray
 method Locality: synthetic Sample: at T = 878 C
;
_journal_name_full               'Physica Status Solidi'
_journal_page_first              984
_journal_page_last               987
_journal_paper_doi               10.1002/pssb.19620020803
_journal_volume                  2
_journal_year                    1962
_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                   5.4515
_cell_length_b                   5.4515
_cell_length_c                   5.4515
_cell_formula_units_Z            8
_cell_volume                     162.012
_database_code_amcsd             0015109
_diffrn_ambient_temperature      1151.15
_exptl_crystal_density_diffrn    2.303
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9013108
High-pressure structures of Ge above 100 GPa Locality: sytnthetic Sample: at P = 135 GPa Note: structure theoretically calculated based on experimental data
Takemura, K.; Schwarz, U.; Syassen, K.; Christensen, N. E.; Hanfland, M.; Novikov, D. L.; Loa, I.; Physica Status Solidi B 223 (2001) 385–390; doi:10.1002/1521-3951(200101)223:2<385::AID-PSSB385>3.0.CO;2-E

data_9013109
_publ_section_title
;
 High-pressure structures of Ge above 100 GPa
 Locality: sytnthetic
 Sample: at P = 135 GPa
 Note: structure theoretically calculated based on experimental data
;
_journal_name_full               'Physica Status Solidi B'
_journal_page_first              385
_journal_page_last               390
_journal_paper_doi
10.1002/1521-3951(200101)223:2<385::AID-PSSB385>3.0.CO;2-E
_journal_volume                  223
_journal_year                    2001
_chemical_formula_sum            Ge
_chemical_name_common            Germanium
_space_group_IT_number           64
_space_group_name_Hall           '-C 2ac 2'
_space_group_name_H-M_alt        'C m c e'
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c e'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.886
_cell_length_b                   4.656
_cell_length_c                   4.667
_cell_formula_units_Z            16
_cell_volume                     171.359
_diffrn_ambient_pressure         1.35e+08
_exptl_crystal_density_diffrn    11.258
_cod_original_sg_symbol_H-M      'C m c a'
_cod_database_code               9013109
_database_code_amcsd 0015111
Crystal structure of ordered white phosphorus (β-P) Sample: at T = 158.15 K Note: beta phase; transforms from alpha phase at T = 196.75 K
Simon, A.; Borrmann, H.; Craubner, H.; Phosphorus and Sulfur and the Related Elements 30 (1987) 507–510; doi:10.1080/03086648708080631

data_9013110
_publ_section_title
;
 Crystal structure of ordered white phosphorus (\b-P)
 Sample: at T = 158.15 K
 Note: beta phase; transforms from alpha phase at T = 196.75 K
;
_journal_name_full
'Phosphorus and Sulfur and the Related Elements'
_journal_page_first              507
_journal_page_last               510
_journal_paper_doi               10.1080/03086648708080631
_journal_volume                  30
_journal_year                    1987
_chemical_compound_source        Synthetic
_chemical_formula_sum            P4
_chemical_name_common            Phosphorus
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                71.84
_cell_angle_beta                 90.37
_cell_angle_gamma                71.56
_cell_formula_units_Z            6
_cell_length_a                   11.450
_cell_length_b                   5.503
_cell_length_c                   11.261
_cell_volume                     635.231
_diffrn_ambient_temperature      158.15
_exptl_crystal_density_diffrn    1.943
_cod_depositor_comments
;
 Added the _cell_formula_units_Z data item after consulting
 the original publication. Updated the space group information
 and copied several data items from a duplicate COD entry 9016483.

 Antanas Vaitkus,
 2021-04-28
;
_cod_database_code               9013110
On the high-pressure phase transition in beryllium metal Sample: at P = 28.3 GPa Note: phase II
Vijayakumar, V.; Godwal, B. K.; Vohra, Y. K.; Sikka, S. K.; Chidambaram, R.; Journal of Physics F: Metal Physics 14 (1984) L65–L68; doi:10.1088/0305-4608/14/5/002

data_9013111
_publ_section_title
;
 On the high-pressure phase transition in beryllium metal
 Sample: at P = 28.3 GPa
 Note: phase II
;
_journal_name_full               'Journal of Physics F: Metal Physics'
_journal_page_first              L65
_journal_page_last               L68
_journal_paper_doi               10.1088/0305-4608/14/5/002
_journal_volume                  14
_journal_year                    1984
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_space_group_IT_number           18
_symmetry_space_group_name_Hall  'P 2 2ab'
_symmetry_space_group_name_H-M   'P 21 21 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   2.168
_cell_length_b                   3.755
_cell_length_c                   3.416
_cell_formula_units_Z            4
_cell_volume                     27.809
_database_code_amcsd             0013191
_diffrn_ambient_pressure         2.83e+07
_exptl_crystal_density_diffrn    2.153
_cod_database_code               9013111