LMucko/crystallography-open-database huggingface dataset:
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 8.3 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002321
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 8.3 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2966
_cell_length_b                   8.2966
_cell_length_c                   8.2966
_cell_formula_units_Z            8
_cell_volume                     571.085
_database_code_amcsd             0002405
_diffrn_ambient_pressure         8.3e+06
_exptl_crystal_density_diffrn    5.386
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002321
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 11.3 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002322
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 11.3 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2626
_cell_length_b                   8.2626
_cell_length_c                   8.2626
_cell_formula_units_Z            8
_cell_volume                     564.092
_database_code_amcsd             0002406
_diffrn_ambient_pressure         1.13e+07
_exptl_crystal_density_diffrn    5.453
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002322
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 12.5 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002323
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 12.5 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2547
_cell_length_b                   8.2547
_cell_length_c                   8.2547
_cell_formula_units_Z            8
_cell_volume                     562.476
_database_code_amcsd             0002407
_diffrn_ambient_pressure         1.25e+07
_exptl_crystal_density_diffrn    5.468
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002323
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 13.5 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002324
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 13.5 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2396
_cell_length_b                   8.2396
_cell_length_c                   8.2396
_cell_formula_units_Z            8
_cell_volume                     559.395
_database_code_amcsd             0002408
_diffrn_ambient_pressure         1.35e+07
_exptl_crystal_density_diffrn    5.498
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002324
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 15.7 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002325
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 15.7 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2321
_cell_length_b                   8.2321
_cell_length_c                   8.2321
_cell_formula_units_Z            8
_cell_volume                     557.869
_database_code_amcsd             0002409
_diffrn_ambient_pressure         1.57e+07
_exptl_crystal_density_diffrn    5.514
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002325
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 17.5 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002326
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 17.5 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.2140
_cell_length_b                   8.2140
_cell_length_c                   8.2140
_cell_formula_units_Z            8
_cell_volume                     554.197
_database_code_amcsd             0002410
_diffrn_ambient_pressure         1.75e+07
_exptl_crystal_density_diffrn    5.550
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002326
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 19.4 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002327
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 19.4 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.1891
_cell_length_b                   8.1891
_cell_length_c                   8.1891
_cell_formula_units_Z            8
_cell_volume                     549.172
_database_code_amcsd             0002411
_diffrn_ambient_pressure         1.94e+07
_exptl_crystal_density_diffrn    5.601
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002327
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 21.8 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002328
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 21.8 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.1710
_cell_length_b                   8.1710
_cell_length_c                   8.1710
_cell_formula_units_Z            8
_cell_volume                     545.539
_database_code_amcsd             0002412
_diffrn_ambient_pressure         2.18e+07
_exptl_crystal_density_diffrn    5.638
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002328
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 24.2 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002329
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 24.2 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.1509
_cell_length_b                   8.1509
_cell_length_c                   8.1509
_cell_formula_units_Z            8
_cell_volume                     541.523
_database_code_amcsd             0002413
_diffrn_ambient_pressure         2.42e+07
_exptl_crystal_density_diffrn    5.680
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002329
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 26.9 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002330
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 26.9 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.1177
_cell_length_b                   8.1177
_cell_length_c                   8.1177
_cell_formula_units_Z            8
_cell_volume                     534.933
_database_code_amcsd             0002414
_diffrn_ambient_pressure         2.69e+07
_exptl_crystal_density_diffrn    5.750
_cod_original_cell_volume        534.932
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002330
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at P = 30.3 GPa
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002331
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at P = 30.3 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.0636
_cell_length_b                   8.0636
_cell_length_c                   8.0636
_cell_formula_units_Z            8
_cell_volume                     524.309
_database_code_amcsd             0002415
_diffrn_ambient_pressure         3.03e+07
_exptl_crystal_density_diffrn    5.866
_cod_original_cell_volume        524.308
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9002331
Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure Sample at 40 GPa, CaTi2O4 structure type
Haavik, C.; Stolen, S.; Fjellvag, H.; Hanfland, M.; Hausermann, D.; American Mineralogist 85 (2000) 514–523; doi:

data_9002332
_publ_section_title
;
 Equation of state of magnetite and its high-pressure modification:
 Thermodynamics of the Fe-O system at high pressure
 Sample at 40 GPa, CaTi2O4 structure type
;
_journal_name_full               'American Mineralogist'
_journal_page_first              514
_journal_page_last               523
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Fe3 O4'
_chemical_name_mineral           Magnetite-h
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-B 2 2b'
_symmetry_space_group_name_H-M   'B b m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   9.273
_cell_length_b                   9.239
_cell_length_c                   2.746
_cell_formula_units_Z            4
_cell_volume                     235.259
_database_code_amcsd             0002416
_exptl_crystal_density_diffrn    6.537
_cod_database_code               9002332
Leverage analysis and structure refinement of minerals Sample: from Dora Maira 3
Merli, M.; Ungaretti, L.; Oberti, R.; American Mineralogist 85 (2000) 532–542; doi:

data_9002333
_publ_section_title
;
 Leverage analysis and structure refinement of minerals
 Sample: from Dora Maira 3
;
_journal_name_full               'American Mineralogist'
_journal_page_first              532
_journal_page_last               542
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Al2 Mg3 O12 Si3'
_chemical_name_mineral           Pyrope
_space_group_IT_number           230
_symmetry_space_group_name_Hall  '-I 4bd 2c 3'
_symmetry_space_group_name_H-M   'I a -3 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   11.4573
_cell_length_b                   11.4573
_cell_length_c                   11.4573
_cell_formula_units_Z            8
_cell_volume                     1503.997
_database_code_amcsd             0002417
_exptl_crystal_density_diffrn    3.561
_cod_original_formula_sum        'Mg3 Al2 Si3 O12'
_cod_database_code               9002333
Leverage analysis and structure refinement of minerals Sample: from Val Tremola 9527
Merli, M.; Ungaretti, L.; Oberti, R.; American Mineralogist 85 (2000) 532–542; doi:

data_9002334
_publ_section_title
;
 Leverage analysis and structure refinement of minerals
 Sample: from Val Tremola 9527
;
_journal_name_full               'American Mineralogist'
_journal_page_first              532
_journal_page_last               542
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Ca2 H2 Mg5 O24 Si8'
_chemical_name_mineral           Tremolite
_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                 104.750
_cell_angle_gamma                90
_cell_length_a                   9.8359
_cell_length_b                   18.0450
_cell_length_c                   5.2752
_cell_formula_units_Z            2
_cell_volume                     905.434
_database_code_amcsd             0002418
_exptl_crystal_density_diffrn    2.980
_cod_original_cell_volume        905.435
_cod_original_formula_sum        'Si8 Mg5 Ca2 H2 O24'
_cod_database_code               9002334
P4/n and P4nc long-ranged ordering in low-temperature vesuvianites Sample: from N'chwaning II mine, RSA
Armbruster, T.; Gnos, E.; American Mineralogist 85 (2000) 563–569; doi:

data_9002335
_publ_section_title
;
 P4/n and P4nc long-ranged ordering in low-temperature vesuvianites
 Sample: from N'chwaning II mine, RSA
;
_journal_name_full               'American Mineralogist'
_journal_page_first              563
_journal_page_last               569
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum
'Al12 Ca18.76 H9 Mg0.148 Mn0.852 Na0.24 O78 Si18'
_chemical_name_mineral           Vesuvianite
_space_group_IT_number           104
_symmetry_space_group_name_Hall  'P 4 -2n'
_symmetry_space_group_name_H-M   'P 4 n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   15.487
_cell_length_b                   15.487
_cell_length_c                   11.764
_cell_formula_units_Z            2
_cell_volume                     2821.562
_database_code_amcsd             0002419
_exptl_crystal_density_diffrn    3.406
_cod_original_formula_sum
'Si18 Al12 Ca18.76 Na.24 O78 H9 Mn.852 Mg.148'
_cod_database_code               9002335
P4/n and P4nc long-ranged ordering in low-temperature vesuvianites Sample: from Asbestos Quebec, Canada
Armbruster, T.; Gnos, E.; American Mineralogist 85 (2000) 563–569; doi:

data_9002336
_publ_section_title
;
 P4/n and P4nc long-ranged ordering in low-temperature vesuvianites
 Sample: from Asbestos Quebec, Canada
;
_journal_name_full               'American Mineralogist'
_journal_page_first              563
_journal_page_last               569
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Al5 Ca9.88 Fe H4 Mg O39 Si9'
_chemical_name_mineral           Vesuvianite
_space_group_IT_number           85
_symmetry_space_group_name_Hall  '-P 4a'
_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                   15.531
_cell_length_b                   15.531
_cell_length_c                   11.817
_cell_formula_units_Z            4
_cell_volume                     2850.402
_database_code_amcsd             0002420
_exptl_crystal_density_diffrn    3.476
_cod_original_sg_symbol_H-M      'P 4/n'
_cod_original_formula_sum        'Si9 Al5 Mg Ca9.88 O39 H4 Fe'
_cod_database_code               9002336
Tetrahedral vacancies and cation ordering in low-temperature Mn-bearing vesuvianites: Indication of a hydrogarnet-like substitution Sample: NC14-2
Armbruster, T.; Gnos, E.; American Mineralogist 85 (2000) 570–577; doi:

data_9002337
_publ_section_title
;
 Tetrahedral vacancies and cation ordering in low-temperature Mn-bearing
 vesuvianites: Indication of a hydrogarnet-like substitution
 Sample: NC14-2
;
_journal_name_full               'American Mineralogist'
_journal_page_first              570
_journal_page_last               577
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum            'Al4.74 B0.24 Ca9.5 Mn1.76 O39.2 Si8.67'
_chemical_name_mineral           Vesuvianite
_space_group_IT_number           85
_symmetry_space_group_name_Hall  '-P 4a'
_symmetry_space_group_name_H-M   'P 4/n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   15.571
_cell_length_b                   15.571
_cell_length_c                   11.789
_cell_volume                     2858.314
_database_code_amcsd             0002421
_exptl_crystal_density_diffrn    3.436
_cod_original_sg_symbol_H-M      'P 4/n'
_cod_original_formula_sum        'Si8.67 Al4.74 Mn1.76 Ca9.5 O39.2 B.24'
_cod_database_code               9002337
Sodic-ferripedrizite, a new monoclinic amphibole bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups Note: site occupancy unknown Sample: crystal P(1)
Oberti, R.; Caballero, J. M.; Ottolini, L.; Lopez-Andres S; Herreros, V.; American Mineralogist 85 (2000) 578–585; doi:

data_9002338
_publ_section_title
;
 Sodic-ferripedrizite, a new monoclinic amphibole
 bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups
 Note: site occupancy unknown
 Sample: crystal P(1)
;
_journal_name_full               'American Mineralogist'
_journal_page_first              578
_journal_page_last               585
_journal_volume                  85
_journal_year                    2000
_chemical_formula_sum
'Al0.2 Ca0.04 F0.84 Fe1.98 H1.16 K0.03 Li2.24 Mg1.76 Na1.3 O23.16 Si8'
_chemical_name_mineral           Sodic-ferripedrizite
_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                 102.54
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.536
_cell_length_b                   17.797
_cell_length_c                   5.278
_cell_volume                     874.373
_database_code_amcsd             0002422
_exptl_crystal_density_diffrn    3.112
_cod_original_formula_sum
'O23.16 F.84 Si8 Fe1.98 Mg1.76 Al.2 Li2.24 Na1.3 Ca.04 K.03 H1.16'
_cod_database_code               9002338