LMucko/crystallography-open-database huggingface dataset:
Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure
Takeda, T.; Takano, M.; Kawamoto, Y.; Kanno, R.; Kamiyama, T.; Kawasaki, S.; Izumi, F.; Solid State Sciences 2 (2000) 673–687; doi:

data_1526749
_publ_section_title
;
 Metal-semiconductor transition, charge disproportionation, and
 low-temperature structure of Ca1-x Srx Fe O3 synthesized under
 high-oxygen pressure
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              673
_journal_page_last               687
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'Ca Fe O3'
_chemical_name_systematic        'Ca (Fe O3)'
_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                 90.063
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.31301
_cell_length_b                   5.34719
_cell_length_c                   7.52351
_cell_volume                     213.740
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Takeda_SSSCFJ_2000_653.cif
_cod_data_source_block           Ca1Fe1O3
_cod_original_cell_volume        213.7403
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Ca1 Fe1 O3'
_cod_database_code               1526749
Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)
Kranenberg, C.; Mewis, A.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1448–1453; doi:

data_1526750
_publ_section_title
;
 Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln :
 Y, Tb - Lu)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1448
_journal_page_last               1453
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al Er2 Si2'
_chemical_name_systematic        'Er2 Al Si2'
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.529
_cell_length_b                   5.719
_cell_length_c                   4.011
_cell_volume                     195.646
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kranenberg_ZAACAB_2000_744.cif
_cod_data_source_block           Al1Er2Si2
_cod_original_formula_sum        'Al1 Er2 Si2'
_cod_database_code               1526750
Metal-semiconductor transition, charge disproportionation, and low-temperature structure of Ca1-x Srx Fe O3 synthesized under high-oxygen pressure
Takeda, T.; Kanno, R.; Kawamoto, Y.; Takano, M.; Kawasaki, S.; Kamiyama, T.; Izumi, F.; Solid State Sciences 2 (2000) 673–687; doi:

data_1526751
_publ_section_title
;
 Metal-semiconductor transition, charge disproportionation, and
 low-temperature structure of Ca1-x Srx Fe O3 synthesized under
 high-oxygen pressure
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              673
_journal_page_last               687
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'Ca Fe O3'
_chemical_name_systematic        'Ca (Fe O3)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.35168
_cell_length_b                   7.54004
_cell_length_c                   5.32613
_cell_volume                     214.919
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Takeda_SSSCFJ_2000_656.cif
_cod_data_source_block           Ca1Fe1O3
_cod_original_cell_volume        214.9194
_cod_original_formula_sum        'Ca1 Fe1 O3'
_cod_database_code               1526751
Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)
Kranenberg, C.; Mewis, A.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1448–1453; doi:

data_1526752
_publ_section_title
;
 Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln :
 Y, Tb - Lu)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1448
_journal_page_last               1453
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al Si2 Tm2'
_chemical_name_systematic        'Tm2 Al Si2'
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.454
_cell_length_b                   5.737
_cell_length_c                   3.984
_cell_volume                     193.226
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kranenberg_ZAACAB_2000_745.cif
_cod_data_source_block           Al1Si2Tm2
_cod_original_cell_volume        193.2264
_cod_original_formula_sum        'Al1 Si2 Tm2'
_cod_database_code               1526752
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Richardson, J.W.jr.; Loong, C.-K.; Guan, J.; Dorris, S.E.; Balachandran, U.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526753
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.9 O2.95 Y0.1'
_chemical_name_systematic        'Ba (Ce0.9 Y0.1) O2.95'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2n 2a'
_symmetry_space_group_name_H-M   'P m c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.774
_cell_length_b                   6.239
_cell_length_c                   6.204
_cell_volume                     339.613
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_612.cif
_cod_data_source_block           Ba1Ce0.9O2.95Y0.1
_cod_original_cell_volume        339.6131
_cod_original_sg_symbol_Hall     '-P 2ac 2n (y,z,x)'
_cod_original_formula_sum        'Ba1 Ce0.9 O2.95 Y0.1'
_cod_database_code               1526753
Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)
Kranenberg, C.; Mewis, A.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1448–1453; doi:

data_1526754
_publ_section_title
;
 Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln :
 Y, Tb - Lu)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1448
_journal_page_last               1453
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al Lu2 Si2'
_chemical_name_systematic        'Lu2 Al Si2'
_space_group_IT_number           71
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.416
_cell_length_b                   5.662
_cell_length_c                   4.001
_cell_volume                     190.653
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kranenberg_ZAACAB_2000_746.cif
_cod_data_source_block           Al1Lu2Si2
_cod_original_cell_volume        190.6532
_cod_original_formula_sum        'Al1 Lu2 Si2'
_cod_database_code               1526754
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526755
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.7 O2.85 Y0.3'
_chemical_name_systematic        'Ba (Ce0.7 Y0.3) O2.85'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   6.218
_cell_length_b                   6.218
_cell_length_c                   15.192
_cell_volume                     508.683
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_614.cif
_cod_data_source_block           Ba1Ce0.7O2.85Y0.3
_cod_original_cell_volume        508.6828
_cod_original_formula_sum        'Ba1 Ce0.7 O2.85 Y0.3'
_cod_database_code               1526755
Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln : Y, Tb - Lu)
Kranenberg, C.; Mewis, A.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1448–1453; doi:

data_1526756
_publ_section_title
;
 Darstellung und Kristallstrukturen von Ln2 Al3 Si2 und Ln2 Al Si2 (Ln :
 Y, Tb - Lu)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1448
_journal_page_last               1453
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al Si2 Yb2'
_chemical_name_systematic        'Yb2 Al Si2'
_space_group_IT_number           127
_symmetry_space_group_name_Hall  '-P 4 2ab'
_symmetry_space_group_name_H-M   'P 4/m b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.765
_cell_length_b                   6.765
_cell_length_c                   4.226
_cell_volume                     193.404
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kranenberg_ZAACAB_2000_747.cif
_cod_data_source_block           Al1Si2Yb2
_cod_original_cell_volume        193.4038
_cod_original_formula_sum        'Al1 Si2 Yb2'
_cod_database_code               1526756
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Guan, J.; Dorris, S.E.; Richardson, J.W.jr.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526757
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.8 O2.9 Y0.2'
_chemical_name_systematic        'Ba (Ce0.8 Y0.2) O2.9'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   6.211
_cell_length_b                   6.211
_cell_length_c                   15.196
_cell_volume                     507.672
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_615.cif
_cod_data_source_block           Ba1Ce0.8O2.9Y0.2
_cod_original_cell_volume        507.6717
_cod_original_formula_sum        'Ba1 Ce0.8 O2.9 Y0.2'
_cod_database_code               1526757
K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp
Kraus, M.; Mueller, B.G.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1929–1933; doi:

data_1526758
_publ_section_title
;
 K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1929
_journal_page_last               1933
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Cu F7 K Zr'
_chemical_name_systematic        'K Cu Zr F7'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.2963
_cell_length_b                   12.7646
_cell_length_c                   10.1156
_cell_volume                     1071.231
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kraus_ZAACAB_2000_760.cif
_cod_data_source_block           Cu1F7K1Zr1
_cod_original_formula_sum        'Cu1 F7 K1 Zr1'
_cod_database_code               1526758
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Loong, C.-K.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.; Balachandran, U.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526759
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.85 O2.925 Y0.15'
_chemical_name_systematic        'Ba (Ce0.85 Y0.15) O2.925'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.58
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.231
_cell_length_b                   8.76
_cell_length_c                   6.214
_cell_volume                     339.165
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_616.cif
_cod_data_source_block           Ba1Ce0.85O2.925Y0.15
_cod_original_cell_volume        339.1649
_cod_original_sg_symbol_Hall     '-C 2y (x,y,-x+z)'
_cod_original_formula_sum        'Ba1 Ce0.85 O2.925 Y0.15'
_cod_database_code               1526759
K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp
Kraus, M.; Mueller, B.G.; Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 1929–1933; doi:

data_1526760
_publ_section_title
;
 K Cu M(IV) F7 (M(IV) = Zr(4+), Hf(4+)), ein neuer Strukturtyp
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1929
_journal_page_last               1933
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Cu F7 Hf K'
_chemical_name_systematic        'K Cu Hf F7'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   8.2894
_cell_length_b                   12.7742
_cell_length_c                   10.0999
_cell_volume                     1069.483
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kraus_ZAACAB_2000_761.cif
_cod_data_source_block           Cu1F7Hf1K1
_cod_original_formula_sum        'Cu1 F7 Hf1 K1'
_cod_database_code               1526760
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Dorris, S.E.; Loong, C.-K.; Guan, J.; Richardson, J.W.jr.; Balachandran, U.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526761
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.8 O2.9 Y0.2'
_chemical_name_systematic        'Ba (Ce0.8 Y0.2) O2.9'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.15
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.242
_cell_length_b                   8.731
_cell_length_c                   6.23
_cell_volume                     339.460
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_617.cif
_cod_data_source_block           Ba1Ce0.8O2.9Y0.2
_cod_original_cell_volume        339.4598
_cod_original_sg_symbol_Hall     '-C 2y (x,y,-x+z)'
_cod_original_formula_sum        'Ba1 Ce0.8 O2.9 Y0.2'
_cod_database_code               1526761
Keggin's ion structural modification and expansion of dodecatungstophosphoric acid hexahydrate induced by temperature treatment : in situ X-ray powder diffraction and Raman investigations
Kremenovic, A.; Spasojevic-de Bire, A.; Sciau, P.; Dimitrijevic, R.; Mioc, U.B.; Colomban, P.; Solid State Ionics 132 (2000) 39–53; doi:

data_1526762
_publ_section_title
;
 Keggin's ion structural modification and expansion of
 dodecatungstophosphoric acid hexahydrate induced by temperature treatment
 : in situ X-ray powder diffraction and Raman investigations
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              39
_journal_page_last               53
_journal_volume                  132
_journal_year                    2000
_chemical_formula_sum            'H15.24 O46.12 P W12'
_chemical_name_systematic        'H3 P W12 O40 (H2 O)6.12'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.1368
_cell_length_b                   12.1368
_cell_length_c                   12.1368
_cell_volume                     1787.774
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Kremenovic_SSIOD3_2000_577.cif
_cod_data_source_block           H15.24O46.12P1W12
_cod_original_formula_sum        'H15.24 O46.12 P1 W12'
_cod_database_code               1526762
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Guan, J.; Dorris, S.E.; Richardson, J.W.jr.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526763
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.75 O2.875 Y0.25'
_chemical_name_systematic        'Ba (Ce0.75 Y0.25) O2.875'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 91.24
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.239
_cell_length_b                   8.726
_cell_length_c                   6.235
_cell_volume                     339.363
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_618.cif
_cod_data_source_block           Ba1Ce0.75O2.875Y0.25
_cod_original_cell_volume        339.3633
_cod_original_sg_symbol_Hall     '-C 2y (x,y,-x+z)'
_cod_original_formula_sum        'Ba1 Ce0.75 O2.875 Y0.25'
_cod_database_code               1526763
Keggin's ion structural modification and expansion of dodecatungstophosphoric acid hexahydrate induced by temperature treatment : in situ X-ray powder diffraction and Raman investigations
Kremenovic, A.; Spasojevic-de Bire, A.; Colomban, P.; Sciau, P.; Dimitrijevic, R.; Mioc, U.B.; Solid State Ionics 132 (2000) 39–53; doi:

data_1526764
_publ_section_title
;
 Keggin's ion structural modification and expansion of
 dodecatungstophosphoric acid hexahydrate induced by temperature treatment
 : in situ X-ray powder diffraction and Raman investigations
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              39
_journal_page_last               53
_journal_volume                  132
_journal_year                    2000
_chemical_formula_sum            'H15 O46 P W12'
_chemical_name_systematic        'H3 P W12 O40 (H2 O)6'
_space_group_IT_number           224
_symmetry_space_group_name_Hall  '-P 4bc 2bc 3'
_symmetry_space_group_name_H-M   'P n -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.1555
_cell_length_b                   12.1555
_cell_length_c                   12.1555
_cell_volume                     1796.050
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Kremenovic_SSIOD3_2000_578.cif
_cod_data_source_block           H15O46P1W12
_cod_original_cell_volume        1796.05
_cod_original_formula_sum        'H15 O46 P1 W12'
_cod_database_code               1526764
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Takeuchi, K.; Richardson, J.W.jr.; Loong, C.-K.; Guan, J.; Dorris, S.E.; Balachandran, U.; Solid State Ionics 138 (2000) 63–77; doi:

data_1526765
_publ_section_title
;
 The crystal structures and phase transitions in Y-doped Ba Ce O3: their
 dependence on Y concentration and hydrogen doping
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              63
_journal_page_last               77
_journal_volume                  138
_journal_year                    2000
_chemical_formula_sum            'Ba Ce0.75 O2.875 Y0.25'
_chemical_name_systematic        'Ba (Ce0.75 Y0.25) O2.875'
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   6.207
_cell_length_b                   6.207
_cell_length_c                   15.163
_cell_volume                     505.917
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Takeuchi_SSIOD3_2000_620.cif
_cod_data_source_block           Ba1Ce0.75O2.875Y0.25
_cod_original_formula_sum        'Ba1 Ce0.75 O2.875 Y0.25'
_cod_database_code               1526765