LMucko/crystallography-open-database huggingface dataset:
Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 600 C
Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.; European Journal of Mineralogy 19 (2007) 15–27; doi:10.1127/0935-1221/2007/0019-0015

data_9010777
_publ_section_title
;
 Order and anti-order in olivine III: variation of the cation distribution,
 in the Fe,Mg olivine solid solution series with temperature and composition
 Sample: CSR-2, T = 600 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              15
_journal_page_last               27
_journal_paper_doi               10.1127/0935-1221/2007/0019-0015
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Saar-Nahe basin, Germany'
_chemical_formula_sum            'Fe0.44 Mg1.56 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.7967
_cell_length_b                   10.3412
_cell_length_c                   6.0543
_cell_formula_units_Z            4
_cell_volume                     300.315
_database_code_amcsd             0007191
_diffrn_ambient_temperature      873.15
_exptl_crystal_density_diffrn    3.419
_cod_original_formula_sum        'Si (Mg1.56 Fe.44) O4'
_cod_database_code               9010777
Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 677 C
Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.; European Journal of Mineralogy 19 (2007) 15–27; doi:10.1127/0935-1221/2007/0019-0015

data_9010778
_publ_section_title
;
 Order and anti-order in olivine III: variation of the cation distribution,
 in the Fe,Mg olivine solid solution series with temperature and composition
 Sample: CSR-2, T = 677 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              15
_journal_page_last               27
_journal_paper_doi               10.1127/0935-1221/2007/0019-0015
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Saar-Nahe basin, Germany'
_chemical_formula_sum            'Fe0.44 Mg1.56 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.8010
_cell_length_b                   10.3537
_cell_length_c                   6.0613
_cell_formula_units_Z            4
_cell_volume                     301.296
_database_code_amcsd             0007192
_diffrn_ambient_temperature      950.15
_exptl_crystal_density_diffrn    3.408
_cod_original_formula_sum        'Si (Mg1.56 Fe.44) O4'
_cod_database_code               9010778
Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 725 C
Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.; European Journal of Mineralogy 19 (2007) 15–27; doi:10.1127/0935-1221/2007/0019-0015

data_9010779
_publ_section_title
;
 Order and anti-order in olivine III: variation of the cation distribution,
 in the Fe,Mg olivine solid solution series with temperature and composition
 Sample: CSR-2, T = 725 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              15
_journal_page_last               27
_journal_paper_doi               10.1127/0935-1221/2007/0019-0015
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Saar-Nahe basin, Germany'
_chemical_formula_sum            'Fe0.44 Mg1.56 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.8046
_cell_length_b                   10.3634
_cell_length_c                   6.0668
_cell_formula_units_Z            4
_cell_volume                     302.078
_database_code_amcsd             0007193
_diffrn_ambient_temperature      998.15
_exptl_crystal_density_diffrn    3.399
_cod_original_formula_sum        'Si (Mg1.56 Fe.44) O4'
_cod_database_code               9010779
Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 800 C
Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.; European Journal of Mineralogy 19 (2007) 15–27; doi:10.1127/0935-1221/2007/0019-0015

data_9010780
_publ_section_title
;
 Order and anti-order in olivine III: variation of the cation distribution,
 in the Fe,Mg olivine solid solution series with temperature and composition
 Sample: CSR-2, T = 800 C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              15
_journal_page_last               27
_journal_paper_doi               10.1127/0935-1221/2007/0019-0015
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Saar-Nahe basin, Germany'
_chemical_formula_sum            'Fe0.44 Mg1.56 O4 Si'
_chemical_name_mineral           Forsterite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.8081
_cell_length_b                   10.3727
_cell_length_c                   6.0722
_cell_formula_units_Z            4
_cell_volume                     302.839
_database_code_amcsd             0007194
_diffrn_ambient_temperature      1073.15
_exptl_crystal_density_diffrn    3.390
_cod_original_formula_sum        'Si (Mg1.56 Fe.44) O4'
_cod_database_code               9010780
The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Hilarion mine, Lavrion, Greece
Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.; European Journal of Mineralogy 19 (2007) 75–93; doi:10.1127/0935-1221/2007/0019-0075

data_9010781
_publ_section_title
;The crystal structures of lavendulan, sampleite, and a new polymorph of
 sampleite Locality: Hilarion mine, Lavrion, Greece
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              75
_journal_page_last               93
_journal_paper_doi               10.1127/0935-1221/2007/0019-0075
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Hilarion mine, Lavrion, Greece'
_chemical_formula_sum            'As4 Ca Cl Cu5 H10 Na O21'
_chemical_name_mineral           Lavendulan
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.37
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.011
_cell_length_b                   19.478
_cell_length_c                   10.056
_cell_volume                     1960.821
_database_code_amcsd             0007195
_exptl_crystal_density_diffrn    3.597
_cod_original_formula_sum        'Na Ca Cu5 As4 O21 Cl H10'
_cod_database_code               9010781
The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Northparkes mine, Goonumbla, New South Wales, Australia
Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.; European Journal of Mineralogy 19 (2007) 75–93; doi:10.1127/0935-1221/2007/0019-0075

data_9010782
_publ_section_title
;The crystal structures of lavendulan, sampleite, and a new polymorph of
 sampleite Locality: Northparkes mine, Goonumbla, New South Wales, Australia
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              75
_journal_page_last               93
_journal_paper_doi               10.1127/0935-1221/2007/0019-0075
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source
'Northparkes mine, Goonumbla, New South Wales, Australia'
_chemical_formula_sum            'Ca Cl Cu5 H10 Na O21 P4'
_chemical_name_mineral           Sampleite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.07
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.676
_cell_length_b                   19.284
_cell_length_c                   9.766
_cell_volume                     1822.256
_database_code_amcsd             0007196
_exptl_crystal_density_diffrn    3.230
_cod_original_formula_sum        'Na Ca Cu5 P4 O21 Cl H10'
_cod_database_code               9010782
The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Lake Boga, Victoria, Australia Note: This is a polymorph or perhaps polytype of sampleite
Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.; European Journal of Mineralogy 19 (2007) 75–93; doi:10.1127/0935-1221/2007/0019-0075

data_9010783
_publ_section_title
;The crystal structures of lavendulan, sampleite, and a new polymorph of
 sampleite Locality: Lake Boga, Victoria, Australia Note: This is a polymorph
 or perhaps polytype of sampleite
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              75
_journal_page_last               93
_journal_paper_doi               10.1127/0935-1221/2007/0019-0075
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source        'Lake Boga, Victoria, Australia'
_chemical_formula_sum            'Ca Cl Cu5 H10 Na O20.56 P4'
_chemical_name_mineral           Sampleite
_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                 102.61
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.695
_cell_length_b                   9.673
_cell_length_c                   19.739
_cell_volume                     1806.467
_database_code_amcsd             0007197
_exptl_crystal_density_diffrn    3.233
_cod_original_formula_sum        'Na Ca Cu5 P4 O20.56 Cl H10'
_cod_database_code               9010783
Fluorcalciobritholite, (Ca,REE)5[(Si,P)O4]3F, a new mineral: description and crystal chemistry Locality: Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia
Pekov, I. V.; Pasero, M.; Yaskovskaya, A. N.; Chukanov, N. V.; Pushcharovsky, D. Y.; Merlino, S.; Zubkova, N. V.; Kononkova, N. N.; Men'shikov, Y. P.; Zadov, A. E.; European Journal of Mineralogy 19 (2007) 95–103; doi:10.1127/0935-1221/2007/0019-0095

data_9010784
_publ_section_title
;Fluorcalciobritholite, (Ca,REE)5[(Si,P)O4]3F, a new mineral: description and
 crystal chemistry Locality: Mount Kukisvumchorr, Khibiny alkaline complex,
 Kola Peninsula, Russia
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              95
_journal_page_last               103
_journal_paper_doi               10.1127/0935-1221/2007/0019-0095
_journal_volume                  19
_journal_year                    2007
_chemical_compound_source
'Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia'
_chemical_formula_sum
'Ca3.006 Ce0.931 F La0.542 Nd0.261 O12 P1.05 Pr0.079 Si1.95 Y0.179'
_chemical_name_mineral           Fluorcalciobritholite
_space_group_IT_number           176
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   9.580
_cell_length_b                   9.580
_cell_length_c                   6.985
_cell_formula_units_Z            2
_cell_volume                     555.173
_database_code_amcsd             0007198
_exptl_crystal_density_diffrn    4.123
_cod_original_formula_sum
'Ca3.006 Ce.931 La.542 Nd.261 Y.179 Pr.079 (Si1.95 P1.05) O12 F'
_cod_database_code               9010784
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 5 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010785
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 5 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39675
_cell_length_b                   7.39675
_cell_length_c                   15.8465
_cell_formula_units_Z            4
_cell_volume                     866.992
_diffrn_ambient_temperature      5
_exptl_crystal_density_diffrn    3.680
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010785
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 25 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010786
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 25 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39640
_cell_length_b                   7.39640
_cell_length_c                   15.8466
_cell_formula_units_Z            4
_cell_volume                     866.916
_diffrn_ambient_temperature      25
_exptl_crystal_density_diffrn    3.680
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010786
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 50 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010787
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 50 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39601
_cell_length_b                   7.39601
_cell_length_c                   15.8469
_cell_formula_units_Z            4
_cell_volume                     866.841
_diffrn_ambient_temperature      50
_exptl_crystal_density_diffrn    3.681
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010787
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 100 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010788
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 100 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39533
_cell_length_b                   7.39533
_cell_length_c                   15.8482
_cell_formula_units_Z            4
_cell_volume                     866.752
_diffrn_ambient_temperature      100
_exptl_crystal_density_diffrn    3.681
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010788
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 150 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010789
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 150 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39482
_cell_length_b                   7.39482
_cell_length_c                   15.8504
_cell_formula_units_Z            4
_cell_volume                     866.753
_diffrn_ambient_temperature      150
_exptl_crystal_density_diffrn    3.681
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010789
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 200 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010790
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 200 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39447
_cell_length_b                   7.39447
_cell_length_c                   15.8534
_cell_formula_units_Z            4
_cell_volume                     866.835
_diffrn_ambient_temperature      200
_exptl_crystal_density_diffrn    3.681
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010790
Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 250 K
Knight, K. S.; Henderson, C. M. B.; European Journal of Mineralogy 19 (2007) 189–200; doi:10.1127/0935-1221/2007/0019-1711

data_9010791
_publ_section_title
;
 Structural basis for the anomalous low-temperature thermal expansion
 behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10
 Sample: T = 250 K
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              189
_journal_page_last               200
_journal_paper_doi               10.1127/0935-1221/2007/0019-1711
_journal_volume                  19
_journal_year                    2007
_chemical_formula_sum            'Ba0.5 Cu O12 Si4 Sr0.5'
_chemical_name_mineral           Effenbergerite
_space_group_IT_number           130
_symmetry_space_group_name_Hall  '-P 4a 2ac'
_symmetry_space_group_name_H-M   'P 4/n c c :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.39428
_cell_length_b                   7.39428
_cell_length_c                   15.8573
_cell_formula_units_Z            4
_cell_volume                     867.004
_diffrn_ambient_temperature      250
_exptl_crystal_density_diffrn    3.680
_cod_original_sg_symbol_H-M      'P 4/n c c'
_cod_original_formula_sum        '(Ba.5 Sr.5) Cu Si4 O12'
_cod_database_code               9010791