LMucko/crystallography-open-database huggingface dataset:
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 700 K, Molar volume = 28.51 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006382
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 700 K, Molar volume = 28.51 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.7425
_cell_length_b                   5.7425
_cell_length_c                   5.7425
_cell_formula_units_Z            4
_cell_volume                     189.366
_database_code_amcsd             0007964
_diffrn_ambient_temperature      700
_exptl_crystal_density_diffrn    2.050
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006382
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 750 K, Molar volume = 28.74 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006383
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 750 K, Molar volume = 28.74 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.7579
_cell_length_b                   5.7579
_cell_length_c                   5.7579
_cell_formula_units_Z            4
_cell_volume                     190.894
_database_code_amcsd             0007965
_diffrn_ambient_temperature      750
_exptl_crystal_density_diffrn    2.034
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006383
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 800 K, Molar volume = 28.98 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006384
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 800 K, Molar volume = 28.98 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.7739
_cell_length_b                   5.7739
_cell_length_c                   5.7739
_cell_formula_units_Z            4
_cell_volume                     192.490
_database_code_amcsd             0007966
_diffrn_ambient_temperature      800
_exptl_crystal_density_diffrn    2.017
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006384
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 850 K, Molar volume = 29.23 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006385
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 850 K, Molar volume = 29.23 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.7904
_cell_length_b                   5.7904
_cell_length_c                   5.7904
_cell_formula_units_Z            4
_cell_volume                     194.145
_database_code_amcsd             0007967
_diffrn_ambient_temperature      850
_exptl_crystal_density_diffrn    1.999
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006385
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 900 K, Molar volume = 29.49 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006386
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 900 K, Molar volume = 29.49 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.8076
_cell_length_b                   5.8076
_cell_length_c                   5.8076
_cell_formula_units_Z            4
_cell_volume                     195.880
_database_code_amcsd             0007968
_diffrn_ambient_temperature      900
_exptl_crystal_density_diffrn    1.982
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006386
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 950 K, Molar volume = 29.77 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006387
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 950 K, Molar volume = 29.77 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.8259
_cell_length_b                   5.8259
_cell_length_c                   5.8259
_cell_formula_units_Z            4
_cell_volume                     197.738
_database_code_amcsd             0007969
_diffrn_ambient_temperature      950
_exptl_crystal_density_diffrn    1.963
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006387
Thermal expansion of alkali halides at high pressure: NaCl as an example Sample: T = 100 K, Molar volume = 30.06 cc/mol
Wang, K.; Reeber, R. R.; Physics and Chemistry of Minerals 23 (1996) 354–360; doi:

data_9006388
_publ_section_title
;
 Thermal expansion of alkali halides at high pressure: NaCl as an example
 Sample: T = 100 K, Molar volume = 30.06 cc/mol
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              354
_journal_page_last               360
_journal_volume                  23
_journal_year                    1996
_chemical_formula_sum            'Cl Na'
_chemical_name_mineral           Halite
_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                   5.8447
_cell_length_b                   5.8447
_cell_length_c                   5.8447
_cell_formula_units_Z            4
_cell_volume                     199.658
_database_code_amcsd             0007970
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    1.944
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_original_formula_sum        'Na Cl'
_cod_database_code               9006388
Structure and crystal chemistry of hydrous wadsleyite, Mg1.75SiH0.5O4: possible hydrous magnesium silicate in the mantle transition zone
Kudoh, Y.; Inoue, T.; Arashi, H.; Physics and Chemistry of Minerals 23 (1996) 461–469; doi:

data_9006389
_publ_section_title
;
 Structure and crystal chemistry of hydrous wadsleyite, Mg1.75SiH0.5O4:
 possible hydrous magnesium silicate in the mantle transition zone
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              461
_journal_page_last               469
_journal_volume                  23
_journal_year                    1996
_chemical_compound_source        Synthetic
_chemical_formula_sum            'H Mg3.47 O8 Si2'
_chemical_name_mineral           Wadsleyite
_space_group_IT_number           74
_symmetry_space_group_name_Hall  '-I 2b 2'
_symmetry_space_group_name_H-M   'I m m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.663
_cell_length_b                   11.546
_cell_length_c                   8.247
_cell_volume                     539.230
_database_code_amcsd             0007971
_exptl_crystal_density_diffrn    3.320
_cod_original_formula_sum        'Mg3.47 Si2 (O8 H)'
_cod_database_code               9006389
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M00
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006390
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M00
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co2 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7825
_cell_length_b                   10.3040
_cell_length_c                   6.0041
_cell_formula_units_Z            4
_cell_volume                     295.875
_database_code_amcsd             0007972
_exptl_crystal_density_diffrn    4.713
_cod_original_formula_sum        'Co2 Si O4'
_cod_database_code               9006390
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M13
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006391
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M13
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co1.75 Mg0.25 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7814
_cell_length_b                   10.2924
_cell_length_c                   6.0007
_cell_formula_units_Z            4
_cell_volume                     295.307
_database_code_amcsd             0007973
_exptl_crystal_density_diffrn    4.528
_cod_original_formula_sum        '(Co1.75 Mg.25) Si O4'
_cod_database_code               9006391
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M251
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006392
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M251
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co1.5 Mg0.5 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7773
_cell_length_b                   10.2800
_cell_length_c                   5.9971
_cell_formula_units_Z            4
_cell_volume                     294.521
_database_code_amcsd             0007974
_exptl_crystal_density_diffrn    4.344
_cod_original_formula_sum        '(Co1.5 Mg.5) Si O4'
_cod_database_code               9006392
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M38
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006393
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M38
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co1.249 Mg0.749 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7754
_cell_length_b                   10.2672
_cell_length_c                   5.9942
_cell_formula_units_Z            4
_cell_volume                     293.896
_database_code_amcsd             0007975
_exptl_crystal_density_diffrn    4.156
_cod_original_formula_sum        'Co1.249 Mg.749 Si O4'
_cod_database_code               9006393
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M502
Muller-Sommer M; Hock R; Kirfel A; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006394
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M502
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co Mg O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7713
_cell_length_b                   10.2533
_cell_length_c                   5.9911
_cell_volume                     293.094
_cod_original_formula_sum        '(Co Mg) Si O4'
_cod_database_code               9006394
_cell_formula_units_Z            4
_database_code_amcsd 0007976
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M62
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006395
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M62
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co0.75 Mg1.25 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7679
_cell_length_b                   10.2400
_cell_length_c                   5.9884
_cell_formula_units_Z            4
_cell_volume                     292.373
_database_code_amcsd             0007977
_exptl_crystal_density_diffrn    3.786
_cod_original_formula_sum        '(Co.75 Mg1.25) Si O4'
_cod_database_code               9006395
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M75
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006396
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M75
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co0.499 Mg1.499 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7633
_cell_length_b                   10.2290
_cell_length_c                   5.9874
_cell_formula_units_Z            4
_cell_volume                     291.729
_database_code_amcsd             0007978
_exptl_crystal_density_diffrn    3.596
_cod_original_formula_sum        'Co.499 Mg1.499 Si O4'
_cod_database_code               9006396
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M87
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006397
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M87
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co0.249 Mg1.749 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7585
_cell_length_b                   10.2148
_cell_length_c                   5.9846
_cell_formula_units_Z            4
_cell_volume                     290.894
_database_code_amcsd             0007979
_exptl_crystal_density_diffrn    3.408
_cod_original_formula_sum        'Co.249 Mg1.749 Si O4'
_cod_database_code               9006397
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: MR100
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006398
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: MR100
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Mg2 O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7536
_cell_length_b                   10.2066
_cell_length_c                   5.9845
_cell_formula_units_Z            4
_cell_volume                     290.357
_database_code_amcsd             0007980
_exptl_crystal_density_diffrn    3.218
_cod_original_formula_sum        'Mg2 Si O4'
_cod_database_code               9006398
Rietveld refinement study of the cation distribution in (Co, Mg)-olivine solid solution Sample: M501
Muller-Sommer M; Hock, R.; Kirfel, A.; Physics and Chemistry of Minerals 24 (1997) 17–23; doi:10.1007/s002690050013

data_9006399
_publ_section_title
;
 Rietveld refinement study of the cation distribution in (Co, Mg)-olivine
 solid solution
 Sample: M501
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              17
_journal_page_last               23
_journal_paper_doi               10.1007/s002690050013
_journal_volume                  24
_journal_year                    1997
_chemical_formula_sum            'Co Mg O4 Si'
_chemical_name_mineral           Olivine
_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                   4.7717
_cell_length_b                   10.2542
_cell_length_c                   5.9914
_cell_formula_units_Z            4
_cell_volume                     293.159
_database_code_amcsd             0007981
_exptl_crystal_density_diffrn    3.972
_cod_original_formula_sum        '(Co Mg) Si O4'
_cod_database_code               9006399