LMucko/crystallography-open-database huggingface dataset:
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 5.78 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003049
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 5.78 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.030
_cell_angle_gamma                90
_cell_length_a                   9.4350
_cell_length_b                   8.5780
_cell_length_c                   5.1894
_cell_volume                     401.580
_cell_formula_units_Z            4
_database_code_amcsd             0003138
_diffrn_ambient_pressure         5.78e+06
_exptl_crystal_density_diffrn    3.757
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003049
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 6.25 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003050
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 6.25 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.999
_cell_angle_gamma                90
_cell_length_a                   9.4295
_cell_length_b                   8.5700
_cell_length_c                   5.1844
_cell_volume                     400.651
_cell_formula_units_Z            4
_database_code_amcsd             0003139
_diffrn_ambient_pressure         6.25e+06
_exptl_crystal_density_diffrn    3.766
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003050
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 7.08 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003051
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.08 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.910
_cell_angle_gamma                90
_cell_length_a                   9.4110
_cell_length_b                   8.5517
_cell_length_c                   5.1729
_cell_volume                     398.315
_cell_formula_units_Z            4
_database_code_amcsd             0003140
_diffrn_ambient_pressure         7.08e+06
_exptl_crystal_density_diffrn    3.788
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003051
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 7.23 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003052
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.23 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.915
_cell_angle_gamma                90
_cell_length_a                   9.4105
_cell_length_b                   8.5481
_cell_length_c                   5.1727
_cell_volume                     398.100
_cell_formula_units_Z            4
_database_code_amcsd             0003141
_diffrn_ambient_pressure         7.23e+06
_exptl_crystal_density_diffrn    3.790
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003052
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 7.39 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003053
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 7.39 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.892
_cell_angle_gamma                90
_cell_length_a                   9.4059
_cell_length_b                   8.5472
_cell_length_c                   5.1703
_cell_volume                     397.728
_cell_formula_units_Z            4
_database_code_amcsd             0003142
_diffrn_ambient_pressure         7.39e+06
_exptl_crystal_density_diffrn    3.794
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003053
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 8.50 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003054
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 8.50 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.776
_cell_angle_gamma                90
_cell_length_a                   9.3836
_cell_length_b                   8.5201
_cell_length_c                   5.1560
_cell_volume                     394.674
_cell_formula_units_Z            4
_database_code_amcsd             0003143
_diffrn_ambient_pressure         8.5e+06
_exptl_crystal_density_diffrn    3.823
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003054
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 8.97 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003055
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 8.97 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.721
_cell_angle_gamma                90
_cell_length_a                   9.3742
_cell_length_b                   8.5086
_cell_length_c                   5.1484
_cell_volume                     393.280
_cell_formula_units_Z            4
_database_code_amcsd             0003144
_diffrn_ambient_pressure         8.97e+06
_exptl_crystal_density_diffrn    3.836
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003055
High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of anisotropic compression in pyroxenes Sample: P = 9.28 GPa
Origlieri, M. J.; Downs, R. T.; Thompson, R. M.; Pommier, C. J. S.; Denton, M. B.; Harlow, G. E.; American Mineralogist 88 (2003) 1025–1032; doi:

data_9003056
_publ_section_title
;
 High-pressure crystal structure of kosmochlor, NaCrSi2O6, and systematics of
 anisotropic compression in pyroxenes
 Sample: P = 9.28 GPa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1025
_journal_page_last               1032
_journal_volume                  88
_journal_year                    2003
_chemical_formula_structural     NaCr(Si2O6)
_chemical_formula_sum            'Cr Na O6 Si2'
_chemical_name_mineral           Kosmochlor
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 106.717
_cell_angle_gamma                90
_cell_length_a                   9.3694
_cell_length_b                   8.5028
_cell_length_c                   5.1456
_cell_volume                     392.605
_cell_formula_units_Z            4
_database_code_amcsd             0003145
_diffrn_ambient_pressure         9.28e+06
_exptl_crystal_density_diffrn    3.843
_cod_original_formula_sum        'Na Cr Si2 O6'
_cod_database_code               9003056
The crystal chemistry of julgoldite-Fe3+ from Bombay, India, studied using synchrotron X-ray powder diffraction and 57Fe Mossbauer spectroscopy
Artioli, G.; Geiger, C. A.; Dapiaggi, M.; American Mineralogist 88 (2003) 1084–1090; doi:

data_9003057
_publ_section_title
;
 The crystal chemistry of julgoldite-Fe3+ from Bombay, India, studied using
 synchrotron X-ray powder diffraction and 57Fe Mossbauer spectroscopy
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1084
_journal_page_last               1090
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum            'Al0.312 Ca2 Fe2.688 H4 O14 Si3'
_chemical_name_mineral           Julgoldite-(Fe3+)
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-A 2y'
_symmetry_space_group_name_H-M   'A 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 97.498
_cell_angle_gamma                90
_cell_length_a                   8.8879
_cell_length_b                   6.0580
_cell_length_c                   19.3321
_cell_formula_units_Z            4
_cell_volume                     1031.996
_database_code_amcsd             0003146
_exptl_crystal_density_diffrn    3.546
_cod_original_formula_sum        'Ca2 Fe2.688 Al.312 Si3 O14 H4'
_cod_database_code               9003057
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-1, before heat treatment
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003058
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-1, before heat treatment
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.195 Fe0.838 Mg0.922 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.49
_cell_angle_gamma                90
_cell_length_a                   9.716
_cell_length_b                   8.946
_cell_length_c                   5.252
_cell_formula_units_Z            4
_cell_volume                     432.935
_database_code_amcsd             0003147
_exptl_crystal_density_diffrn    3.539
_cod_original_formula_sum        'O6 Si2 Mg.922 Fe.838 Mn.027 Ca.195'
_cod_database_code               9003058
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-2, after heating at 700 deg C
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003059
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-2, after heating at 700 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.195 Fe0.834 Mg0.926 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.52
_cell_angle_gamma                90
_cell_length_a                   9.708
_cell_length_b                   8.941
_cell_length_c                   5.244
_cell_formula_units_Z            4
_cell_volume                     431.603
_database_code_amcsd             0003148
_exptl_crystal_density_diffrn    3.548
_exptl_crystal_thermal_history   'after heating at 700 deg C'
_cod_original_formula_sum        'O6 Si2 Mg.926 Fe.834 Mn.027 Ca.195'
_cod_database_code               9003059
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-3, after heating at 750 deg C
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003060
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-3, after heating at 750 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.195 Fe0.835 Mg0.921 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.48
_cell_angle_gamma                90
_cell_length_a                   9.707
_cell_length_b                   8.941
_cell_length_c                   5.247
_cell_formula_units_Z            4
_cell_volume                     431.906
_database_code_amcsd             0003149
_exptl_crystal_density_diffrn    3.545
_exptl_crystal_thermal_history   'after heating at 750 deg C'
_cod_original_formula_sum        'O6 Si2 Mg.921 Fe.835 Mn.027 Ca.195'
_cod_database_code               9003060
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-4, after heating at 800 deg C
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003061
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-4, after heating at 800 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.193 Fe0.829 Mg0.93 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.47
_cell_angle_gamma                90
_cell_length_a                   9.707
_cell_length_b                   8.943
_cell_length_c                   5.246
_cell_formula_units_Z            4
_cell_volume                     431.946
_database_code_amcsd             0003150
_exptl_crystal_density_diffrn    3.542
_exptl_crystal_thermal_history   'after heating at 800 deg C'
_cod_original_formula_sum        'O6 Si2 Mg.93 Fe.829 Mn.027 Ca.193'
_cod_database_code               9003061
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-5, after heating at 850 deg C
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003062
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-5, after heating at 850 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.179 Fe0.85 Mg0.921 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.49
_cell_angle_gamma                90
_cell_length_a                   9.711
_cell_length_b                   8.944
_cell_length_c                   5.249
_cell_formula_units_Z            4
_cell_volume                     432.369
_database_code_amcsd             0003151
_exptl_crystal_density_diffrn    3.544
_exptl_crystal_thermal_history   'after heating at 850 deg C'
_cod_original_formula_sum        'O6 Si2 Mg.921 Fe.85 Mn.027 Ca.179'
_cod_database_code               9003062
Coupling between non-convergent ordering and transition temperature in the C2/c - P2_1/c phase transition in pigeonite Sample: BTS-308 n.17-6, after the final in situ run to 500 deg C
Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V.; American Mineralogist 88 (2003) 1115–1128; doi:

data_9003063
_publ_section_title
;
 Coupling between non-convergent ordering and transition temperature
 in the C2/c - P2_1/c phase transition in pigeonite
 Sample: BTS-308 n.17-6, after the final in situ run to 500 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1115
_journal_page_last               1128
_journal_volume                  88
_journal_year                    2003
_chemical_compound_source        'Parana, Brazil'
_chemical_formula_sum            'Ca0.18 Fe0.834 Mg0.942 Mn0.027 O6 Si2'
_chemical_name_mineral           Pigeonite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.50
_cell_angle_gamma                90
_cell_length_a                   9.718
_cell_length_b                   8.951
_cell_length_c                   5.250
_cell_formula_units_Z            4
_cell_volume                     433.076
_database_code_amcsd             0003152
_exptl_crystal_density_diffrn    3.533
_cod_original_formula_sum        'O6 Si2 Mg.942 Fe.834 Mn.027 Ca.18'
_cod_database_code               9003063
Studtite, [(UO2)(O2)(H2O)2](H2O)2: The first structure of a peroxide mineral
Burns, P. C.; Hughes, K.-A.; American Mineralogist 88 (2003) 1165–1168; doi:

data_9003064
_publ_section_title
;
 Studtite, [(UO2)(O2)(H2O)2](H2O)2: The first structure of a peroxide mineral
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1165
_journal_page_last               1168
_journal_volume                  88
_journal_year                    2003
_chemical_formula_sum            'H8 O8 U'
_chemical_name_mineral           Studtite
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 123.356
_cell_angle_gamma                90
_cell_length_a                   14.068
_cell_length_b                   6.721
_cell_length_c                   8.428
_cell_formula_units_Z            4
_cell_volume                     665.607
_database_code_amcsd             0003153
_exptl_crystal_density_diffrn    3.733
_cod_original_formula_sum        'U O8 H8'
_cod_database_code               9003064