LMucko/crystallography-open-database huggingface dataset:
Synthesis, crystal structure and properties of metallic PrNiO~3~: comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
Lacorre, P; Torrance, J B; Pannetier, J; Nazzal, A I; Wang, P W; Huang, T C; Journal of Solid State Chemistry 91 (1991) 225–237; doi:10.1016/0022-4596(91)90077-U

data_1000301
_publ_section_title
;
Synthesis, crystal structure and properties of metallic PrNiO~3~:
comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              225
_journal_page_last               237
_journal_paper_doi               10.1016/0022-4596(91)90077-U
_journal_volume                  91
_journal_year                    1991
_chemical_formula_structural     'Pr Ni O3'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4145(3)
_cell_length_b                   5.3753(2)
_cell_length_c                   7.6206(4)
_cell_volume                     221.8
_refine_ls_R_factor_all          0.02
_cod_database_code               1000301
Synthesis, crystal structure and properties of metallic PrNiO~3~: comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
Lacorre, P; Torrance, J B; Pannetier, J; Nazzal, A I; Wang, P W; Huang, T C; Journal of Solid State Chemistry 91 (1991) 225–237; doi:10.1016/0022-4596(91)90077-U

data_1000302
_publ_section_title
;
Synthesis, crystal structure and properties of metallic PrNiO~3~:
comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              225
_journal_page_last               237
_journal_paper_doi               10.1016/0022-4596(91)90077-U
_journal_volume                  91
_journal_year                    1991
_chemical_formula_structural     'Pr Ni O3'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4154(1)
_cell_length_b                   5.3755(1)
_cell_length_c                   7.6192(2)
_cell_volume                     221.8
_refine_ls_R_factor_all          0.033
_cod_database_code               1000302
Synthesis, crystal structure and properties of metallic PrNiO~3~: comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
Lacorre, P; Torrance, J B; Pannetier, J; Nazzal, A I; Wang, P W; Huang, T C; Journal of Solid State Chemistry 91 (1991) 225–237; doi:10.1016/0022-4596(91)90077-U

data_1000303
_publ_section_title
;
Synthesis, crystal structure and properties of metallic PrNiO~3~:
comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              225
_journal_page_last               237
_journal_paper_doi               10.1016/0022-4596(91)90077-U
_journal_volume                  91
_journal_year                    1991
_chemical_formula_structural     'Nd Ni O3'
_chemical_formula_sum            'Nd Ni O3'
_chemical_name_systematic        'Neodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.3888(2)
_cell_length_b                   5.3845(1)
_cell_length_c                   7.6127(2)
_cell_volume                     220.9
_refine_ls_R_factor_all          0.043
_cod_database_code               1000303
Synthesis, crystal structure and properties of metallic PrNiO~3~: comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
Lacorre, P; Torrance, J B; Pannetier, J; Nazzal, A I; Wang, P W; Huang, T C; Journal of Solid State Chemistry 91 (1991) 225–237; doi:10.1016/0022-4596(91)90077-U

data_1000304
_publ_section_title
;
Synthesis, crystal structure and properties of metallic PrNiO~3~:
comparison with metallic NdNiO~3~ and semiconducting SmNiO~3~
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              225
_journal_page_last               237
_journal_paper_doi               10.1016/0022-4596(91)90077-U
_journal_volume                  91
_journal_year                    1991
_chemical_formula_structural     'Sm Ni O3'
_chemical_formula_sum            'Ni O3 Sm'
_chemical_name_systematic        'Samarium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.3283(1)
_cell_length_b                   5.4374(1)
_cell_length_c                   7.5675(2)
_cell_volume                     219.2
_refine_ls_R_factor_all          0.033
_cod_database_code               1000304
Synthesis and crystal structures of β-NaSrCrF~6~ and NaSrFeF~6~. Structural correlations with A~2~MF~6~ compounds
Hemon, A.; Courbion, G.; European Journal of Solid State and Inorganic Chemistry 29 (1992) 519–531; doi:

data_1000305
_publ_section_title
;
 Synthesis and crystal structures of \b-NaSrCrF~6~ and NaSrFeF~6~.
 Structural correlations with A~2~MF~6~ compounds
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
 European Journal of Solid State and Inorganic Chemistry
;
_journal_page_first              519
_journal_page_last               531
_journal_volume                  29
_journal_year                    1992
_chemical_formula_structural     'Na Sr (Cr F6)'
_chemical_formula_sum            'Cr F6 Na Sr'
_chemical_name_systematic
;
Sodium strontium hexafluorochromate(III) - \b
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_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                 93.201(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.5676(3)
_cell_length_b                   9.2937(7)
_cell_length_c                   9.5858(5)
_cell_volume                     495.2
_refine_ls_R_factor_all          0.03
_cod_database_code               1000305
Synthesis and crystal structures of β-NaSrCrF~6~ and NaSrFeF~6~. Structural correlations with A~2~MF~6~ compounds
Hemon, A.; Courbion, G.; European Journal of Solid State and Inorganic Chemistry 29 (1992) 519–531; doi:

data_1000306
_publ_section_title
;
Synthesis and crystal structures of \b-NaSrCrF~6~ and NaSrFeF~6~.
Structural correlations with A~2~MF~6~ compounds
;
_journal_coden_ASTM              EJSCE5
_journal_name_full
;
 European Journal of Solid State and Inorganic Chemistry
;
_journal_page_first              519
_journal_page_last               531
_journal_volume                  29
_journal_year                    1992
_chemical_formula_structural     'Na Sr Fe F6'
_chemical_formula_sum            'F6 Fe Na Sr'
_chemical_name_systematic        'Sodium strontium iron(III) hexafluoride'
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.4053(3)
_cell_length_b                   9.3103(5)
_cell_length_c                   10.3823(8)
_cell_volume                     522.5
_refine_ls_R_factor_all          0.041
_cod_database_code               1000306
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000307
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'La Ni O3'
_chemical_formula_sum            'La Ni O3'
_chemical_name_systematic        'Lanthanum nickel(III) oxide'
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_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                   5.4535(1)
_cell_length_b                   5.4535(1)
_cell_length_c                   13.1010(3)
_cell_volume                     337.4
_refine_ls_R_factor_all          0.041
_cod_original_sg_symbol_H-M      'R -3 c H'
_cod_database_code               1000307
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000308
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'La (Ni O3)'
_chemical_formula_sum            'La Ni O3'
_chemical_name_systematic        'Lanthanum nickel(III) oxide'
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_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                   5.4535(1)
_cell_length_b                   5.4535(1)
_cell_length_c                   13.1014(3)
_cell_volume                     337.4
_refine_ls_R_factor_all          0.043
_cod_original_sg_symbol_H-M      'R -3 c H'
_cod_database_code               1000308
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000309
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'La (Ni O3)'
_chemical_formula_sum            'La Ni O3'
_chemical_name_systematic        'Lanthanum nickel(III) oxide'
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_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                   5.4536(1)
_cell_length_b                   5.4536(1)
_cell_length_c                   13.1062(3)
_cell_volume                     337.6
_refine_ls_R_factor_all          0.041
_cod_original_sg_symbol_H-M      'R -3 c H'
_cod_database_code               1000309
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000310
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'La (Ni O3)'
_chemical_formula_sum            'La Ni O3'
_chemical_name_systematic        'Lanthanum nickel(III) oxide'
_space_group_IT_number           167
_symmetry_cell_setting           trigonal
_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                   5.4573(1)
_cell_length_b                   5.4573(1)
_cell_length_c                   13.1462(3)
_cell_volume                     339.1
_refine_ls_R_factor_all          0.045
_cod_original_sg_symbol_H-M      'R -3 c H'
_cod_database_code               1000310
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000311
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'Pr (Ni O3)'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4155(1)
_cell_length_b                   5.3884(1)
_cell_length_c                   7.6164(1)
_cell_volume                     222.3
_refine_ls_R_factor_all          0.036
_cod_database_code               1000311
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000312
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'Pr (Ni O3)'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4133(1)
_cell_length_b                   5.3828(1)
_cell_length_c                   7.6227(1)
_cell_volume                     222.1
_refine_ls_R_factor_all          0.036
_cod_database_code               1000312
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000313
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'Pr (Ni O3)'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4115(1)
_cell_length_b                   5.3763(1)
_cell_length_c                   7.6163(1)
_cell_volume                     221.6
_refine_ls_R_factor_all          0.037
_cod_database_code               1000313
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000314
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'Pr (Ni O3)'
_chemical_formula_sum            'Ni O3 Pr'
_chemical_name_systematic        'Praseodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.4193(1)
_cell_length_b                   5.3801(1)
_cell_length_c                   7.6263(1)
_cell_volume                     222.4
_refine_ls_R_factor_all          0.035
_cod_database_code               1000314
Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition
García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B.; Physical Review B: Condensed Matter and Materials Physics 46 (1992) 4414–4425; doi:10.1103/PhysRevB.46.4414

data_1000315
_publ_section_title
;
 Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically
 induced structural changes across the metal-insulator transition
;
_journal_coden_ASTM              PRBMDO
_journal_issue                   8
_journal_name_full
;
 Physical Review B: Condensed Matter and Materials Physics
;
_journal_page_first              4414
_journal_page_last               4425
_journal_paper_doi               10.1103/PhysRevB.46.4414
_journal_volume                  46
_journal_year                    1992
_chemical_formula_structural     'Nd (Ni O3)'
_chemical_formula_sum            'Nd Ni O3'
_chemical_name_systematic        'Neodymium nickel(III) oxide'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_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_formula_units_Z            4
_cell_length_a                   5.3824(3)
_cell_length_b                   5.3861(2)
_cell_length_c                   7.6066(3)
_cell_volume                     220.5
_refine_ls_R_factor_all          0.042
_cod_database_code               1000315