LMucko/crystallography-open-database huggingface dataset:
Megacrystic clinopyroxenes from Victoria (Australia): Crystal chemical comparisons of pyroxenes from high and low pressure regimes Sample: Bu-14
Dal Negro, A.; Manoli, S.; Secco, L.; Piccirillo, E. M.; European Journal of Mineralogy 1 (1989) 105–121; doi:10.1127/ejm/01/1/0105

data_9005009
_publ_section_title
;
 Megacrystic clinopyroxenes from Victoria (Australia):
 Crystal chemical comparisons of pyroxenes from high and low pressure regimes
 Sample: Bu-14
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              105
_journal_page_last               121
_journal_paper_doi               10.1127/ejm/01/1/0105
_journal_volume                  1
_journal_year                    1989
_chemical_compound_source        'Victoria, Australia'
_chemical_formula_sum
'Al0.323 Ca0.661 Cr0.005 Fe0.206 Mg0.771 Mn0.001 Na0.153 O6 Si1.851 Ti0.029'
_chemical_name_mineral           Diopside
_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                 106.57
_cell_angle_gamma                90
_cell_length_a                   9.700
_cell_length_b                   8.858
_cell_length_c                   5.272
_cell_formula_units_Z            4
_cell_volume                     434.172
_database_code_amcsd             0006354
_exptl_crystal_density_diffrn    3.345
_cod_original_formula_sum
'Ca.661 Na.153 Fe.206 Mg.771 Mn.001 Al.323 Ti.029 Cr.005 Si1.851 O6'
_cod_database_code               9005009
Megacrystic clinopyroxenes from Victoria (Australia): Crystal chemical comparisons of pyroxenes from high and low pressure regimes Sample: No-15
Dal Negro, A.; Manoli, S.; Secco, L.; Piccirillo, E. M.; European Journal of Mineralogy 1 (1989) 105–121; doi:10.1127/ejm/01/1/0105

data_9005010
_publ_section_title
;
 Megacrystic clinopyroxenes from Victoria (Australia):
 Crystal chemical comparisons of pyroxenes from high and low pressure regimes
 Sample: No-15
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              105
_journal_page_last               121
_journal_paper_doi               10.1127/ejm/01/1/0105
_journal_volume                  1
_journal_year                    1989
_chemical_compound_source        'Victoria, Australia'
_chemical_formula_sum
'Al0.268 Ca0.673 Cr0.002 Fe0.335 Mg0.685 Mn0.007 Na0.116 O6 Si1.895 Ti0.019'
_chemical_name_mineral           Diopside
_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                 106.54
_cell_angle_gamma                90
_cell_length_a                   9.703
_cell_length_b                   8.870
_cell_length_c                   5.268
_cell_formula_units_Z            4
_cell_volume                     434.633
_database_code_amcsd             0006355
_exptl_crystal_density_diffrn    3.406
_cod_original_formula_sum
'Ca.673 Na.116 Fe.335 Mg.685 Mn.007 Al.268 Ti.019 Cr.002 Si1.895 O6'
_cod_database_code               9005010
Crystal chemistry of double-ring silicates: Structure of natural and dehydrated milarite at 100 K Note: natural sample
Armbruster, T.; Bermanec, V.; Wenger, M.; Oberhansli, R.; European Journal of Mineralogy 1 (1989) 353–362; doi:10.1127/ejm/1/3/0353

data_9005011
_publ_section_title
;
 Crystal chemistry of double-ring silicates:
 Structure of natural and dehydrated milarite at 100 K
 Note: natural sample
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              353
_journal_page_last               362
_journal_paper_doi               10.1127/ejm/1/3/0353
_journal_volume                  1
_journal_year                    1989
_chemical_compound_source        'Val Giuf, Graubunden, Switzerland'
_chemical_formula_sum            'Al0.69 Be2.31 Ca2 K1.153 O30.588 Si12'
_chemical_name_mineral           Milarite
_space_group_IT_number           192
_symmetry_space_group_name_Hall  '-P 6 2c'
_symmetry_space_group_name_H-M   'P 6/m c c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   10.398
_cell_length_b                   10.398
_cell_length_c                   13.771
_cell_volume                     1289.424
_database_code_amcsd             0006356
_exptl_crystal_density_diffrn    2.553
_cod_original_formula_sum        'K1.153 Ca2 (Be2.31 Al.69) Si12 O30.588'
_cod_database_code               9005011
Crystal chemistry of double-ring silicates: Structure of natural and dehydrated milarite at 100 K Note: heated sample
Armbruster, T.; Bermanec, V.; Wenger, M.; Oberhansli, R.; European Journal of Mineralogy 1 (1989) 353–362; doi:10.1127/ejm/1/3/0353

data_9005012
_publ_section_title
;
 Crystal chemistry of double-ring silicates:
 Structure of natural and dehydrated milarite at 100 K
 Note: heated sample
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              353
_journal_page_last               362
_journal_paper_doi               10.1127/ejm/1/3/0353
_journal_volume                  1
_journal_year                    1989
_chemical_formula_sum            'Al0.639 Be2.361 Ca2 K1.37 O30 Si12'
_chemical_name_mineral           Milarite
_space_group_IT_number           192
_symmetry_space_group_name_Hall  '-P 6 2c'
_symmetry_space_group_name_H-M   'P 6/m c c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   10.363
_cell_length_b                   10.363
_cell_length_c                   13.827
_cell_volume                     1285.966
_database_code_amcsd             0006357
_exptl_crystal_density_diffrn    2.555
_cod_original_formula_sum        'K1.37 Ca2 (Be2.361 Al.639) Si12 O30'
_cod_database_code               9005012
Thermal strain analysis in the crystal structure of muscovite at 700 C T = 25 C
Catti, M.; Ferraris, G.; Ivaldi, G.; European Journal of Mineralogy 1 (1989) 625–632; doi:10.1127/ejm/1/5/0625

data_9005013
_publ_section_title
;
 Thermal strain analysis in the crystal structure of muscovite at 700 C
 T = 25 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              625
_journal_page_last               632
_journal_paper_doi               10.1127/ejm/1/5/0625
_journal_volume                  1
_journal_year                    1989
_chemical_formula_sum
'Al2.84 Fe0.06 H2 K0.88 Mg0.02 Na0.11 O12 Si3.08'
_chemical_name_mineral           Muscovite
_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                 95.77
_cell_angle_gamma                90
_cell_length_a                   5.191
_cell_length_b                   9.006
_cell_length_c                   20.068
_cell_formula_units_Z            4
_cell_volume                     933.429
_database_code_amcsd             0006358
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    2.831
_cod_original_formula_sum        'K.88 Na.11 Al2.84 Fe.06 Mg.02 Si3.08 O12 H2'
_cod_database_code               9005013
Thermal strain analysis in the crystal structure of muscovite at 700 C T= 700 C
Catti, M.; Ferraris, G.; Ivaldi, G.; European Journal of Mineralogy 1 (1989) 625–632; doi:10.1127/ejm/1/5/0625

data_9005014
_publ_section_title
;
 Thermal strain analysis in the crystal structure of muscovite at 700 C
 T= 700 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              625
_journal_page_last               632
_journal_paper_doi               10.1127/ejm/1/5/0625
_journal_volume                  1
_journal_year                    1989
_chemical_formula_sum
'Al2.84 Fe0.06 H2 K0.88 Mg0.02 Na0.11 O12 Si3.08'
_chemical_name_mineral           Muscovite
_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                 95.74
_cell_angle_gamma                90
_cell_length_a                   5.229
_cell_length_b                   9.076
_cell_length_c                   20.322
_cell_formula_units_Z            4
_cell_volume                     959.614
_database_code_amcsd             0006359
_diffrn_ambient_temperature      973.15
_exptl_crystal_density_diffrn    2.754
_cod_original_formula_sum        'K.88 Na.11 Al2.84 Fe.06 Mg.02 Si3.08 O12 H2'
_cod_database_code               9005014
Crystal chemistry of double-ring silicates: structure of roedderite at 100 and 300 K T= 100 K
Armbruster, T.; European Journal of Mineralogy 1 (1989) 715–718; doi:10.1127/ejm/1/5/0715

data_9005015
_publ_section_title
;
 Crystal chemistry of double-ring silicates:
 structure of roedderite at 100 and 300 K
 T= 100 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              715
_journal_page_last               718
_journal_paper_doi               10.1127/ejm/1/5/0715
_journal_volume                  1
_journal_year                    1989
_chemical_formula_sum
'Fe0.12 K0.94 Mg4.75 Mn0.1 Na1.02 O30 Si12 Ti0.01'
_chemical_name_mineral           Roedderite
_space_group_IT_number           190
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   10.139
_cell_length_b                   10.139
_cell_length_c                   14.269
_cell_volume                     1270.324
_database_code_amcsd             0006360
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    2.628
_cod_original_formula_sum
'K.94 Na1.02 Mg4.75 Fe.12 Mn.1 Ti.01 Si12 O30'
_cod_database_code               9005015
Crystal chemistry of double-ring silicates: structure of roedderite at 100 and 300 K T= 300 K
Armbruster, T.; European Journal of Mineralogy 1 (1989) 715–718; doi:10.1127/ejm/1/5/0715

data_9005016
_publ_section_title
;
 Crystal chemistry of double-ring silicates:
 structure of roedderite at 100 and 300 K
 T= 300 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              715
_journal_page_last               718
_journal_paper_doi               10.1127/ejm/1/5/0715
_journal_volume                  1
_journal_year                    1989
_chemical_formula_sum
'Fe0.12 K0.94 Mg4.75 Mn0.1 Na1.02 O30 Si12 Ti0.01'
_chemical_name_mineral           Roedderite
_space_group_IT_number           190
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   10.141
_cell_length_b                   10.141
_cell_length_c                   14.286
_cell_volume                     1272.339
_database_code_amcsd             0006361
_diffrn_ambient_temperature      300
_exptl_crystal_density_diffrn    2.624
_cod_original_formula_sum
'K.94 Na1.02 Mg4.75 Fe.12 Mn.1 Ti.01 Si12 O30'
_cod_database_code               9005016
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 298 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005017
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 298 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9137
_cell_length_b                   4.9137
_cell_length_c                   5.4047
_cell_formula_units_Z            3
_cell_volume                     113.011
_database_code_amcsd             0006362
_diffrn_ambient_temperature      298
_exptl_crystal_density_diffrn    2.649
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005017
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 398 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005018
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 398 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9209
_cell_length_b                   4.9209
_cell_length_c                   5.4091
_cell_formula_units_Z            3
_cell_volume                     113.434
_database_code_amcsd             0006363
_diffrn_ambient_temperature      398
_exptl_crystal_density_diffrn    2.639
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005018
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 498 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005019
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 498 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9297
_cell_length_b                   4.9297
_cell_length_c                   5.4151
_cell_formula_units_Z            3
_cell_volume                     113.967
_database_code_amcsd             0006364
_diffrn_ambient_temperature      498
_exptl_crystal_density_diffrn    2.626
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005019
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 597 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005020
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 597 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9384
_cell_length_b                   4.9384
_cell_length_c                   5.4213
_cell_formula_units_Z            3
_cell_volume                     114.500
_database_code_amcsd             0006365
_diffrn_ambient_temperature      597
_exptl_crystal_density_diffrn    2.614
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005020
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 697 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005021
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 697 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9509
_cell_length_b                   4.9509
_cell_length_c                   5.4285
_cell_formula_units_Z            3
_cell_volume                     115.234
_database_code_amcsd             0006366
_diffrn_ambient_temperature      697
_exptl_crystal_density_diffrn    2.597
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005021
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 773 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005022
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 773 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9628
_cell_length_b                   4.9628
_cell_length_c                   5.4360
_cell_formula_units_Z            3
_cell_volume                     115.948
_database_code_amcsd             0006367
_diffrn_ambient_temperature      773
_exptl_crystal_density_diffrn    2.581
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005022
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 813 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005023
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 813 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9728
_cell_length_b                   4.9728
_cell_length_c                   5.4425
_cell_formula_units_Z            3
_cell_volume                     116.555
_database_code_amcsd             0006368
_diffrn_ambient_temperature      813
_exptl_crystal_density_diffrn    2.568
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005023
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 838 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005024
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 838 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9841
_cell_length_b                   4.9841
_cell_length_c                   5.4500
_cell_formula_units_Z            3
_cell_volume                     117.247
_database_code_amcsd             0006369
_diffrn_ambient_temperature      838
_exptl_crystal_density_diffrn    2.553
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005024
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 848 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005025
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 848 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_space_group_IT_number           180
_symmetry_space_group_name_Hall  'P 62 2 (0 0 4)'
_symmetry_space_group_name_H-M   'P 62 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9965
_cell_formula_units_Z            3
_cell_length_b                   4.9965
_cell_length_c                   5.4570
_cell_volume                     117.982
_database_code_amcsd             0006370
_diffrn_ambient_temperature      848
_exptl_crystal_density_diffrn    2.537
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005025
An X-ray study of the temperature dependence of the quartz structure Sample: at T = 854 K
Kihara, K.; European Journal of Mineralogy 2 (1990) 63–77; doi:10.1127/ejm/2/1/0063

data_9005026
_publ_section_title
;
 An X-ray study of the temperature dependence of the quartz structure
 Sample: at T = 854 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              63
_journal_page_last               77
_journal_paper_doi               10.1127/ejm/2/1/0063
_journal_volume                  2
_journal_year                    1990
_chemical_formula_sum            'O2 Si'
_chemical_name_mineral           Quartz
_space_group_IT_number           180
_symmetry_space_group_name_Hall  'P 62 2 (0 0 4)'
_symmetry_space_group_name_H-M   'P 62 2 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.9968
_cell_formula_units_Z            3
_cell_length_b                   4.9968
_cell_length_c                   5.4576
_cell_volume                     118.009
_database_code_amcsd             0006371
_diffrn_ambient_temperature      854
_exptl_crystal_density_diffrn    2.536
_cod_original_formula_sum        'Si O2'
_cod_database_code               9005026