LMucko/crystallography-open-database huggingface dataset:
Ueber einige ternaere Chalkogenide mit Chalkopyritstruktur
Klingler, W.; Meyer, A.D.; Hahn, H.; Frank, G.; Stoerger, G.; Zeitschrift fuer Anorganische und Allgemeine Chemie 271 (1953) 153–170; doi:10.1002/zaac.19532710307

data_1509401
_publ_section_title
;
 Ueber einige ternaere Chalkogenide mit Chalkopyritstruktur
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              153
_journal_page_last               170
_journal_paper_doi               10.1002/zaac.19532710307
_journal_volume                  271
_journal_year                    1953
_chemical_formula_sum            'Ag In S2'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   4.12
_cell_length_b                   4.12
_cell_length_c                   6.67
_cell_volume                     98.051
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            silver1-2_342.cif
_cod_data_source_block           Ag1In1S2
_cod_original_cell_volume        98.05074
_cod_original_formula_sum        'Ag1 In1 S2'
_cod_database_code               1509401
Interatomic interaction aspect of phase transition in Ag In S2 crystals
Rozhdestvenskaya, I.V.; Rud', Yu.V.; Vaipolin, A.A.; Crystal Research and Technology 23 (1988) 337–341; doi:10.1002/crat.2170230309

data_1509402
_publ_section_title
;
 Interatomic interaction aspect of phase transition in Ag In S2 crystals
;
_journal_name_full               'Crystal Research and Technology'
_journal_page_first              337
_journal_page_last               341
_journal_paper_doi               10.1002/crat.2170230309
_journal_volume                  23
_journal_year                    1988
_chemical_formula_sum            'Ag In S2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.876
_cell_length_b                   5.876
_cell_length_c                   11.198
_cell_volume                     386.638
_citation_journal_id_ASTM        CRTEDF
_cod_data_source_file            silver1-2_343.cif
_cod_data_source_block           Ag1In1S2
_cod_original_cell_volume        386.6375
_cod_original_formula_sum        'Ag1 In1 S2'
_cod_database_code               1509402
Simultaneous Rietveld refinement of three phases in the Ag-In-S semiconducting system from x-ray powder diffraction
Delgado, G.; Pineda, C.; Mora, A.J.; Tinoco, T.; Materials Research Bulletin 36 (2001) 2507–2517; doi:10.1016/S0025-5408(01)00741-3

data_1509403
_publ_section_title
;
 Simultaneous Rietveld refinement of three phases in the Ag-In-S
 semiconducting system from x-ray powder diffraction
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              2507
_journal_page_last               2517
_journal_paper_doi               10.1016/S0025-5408(01)00741-3
_journal_volume                  36
_journal_year                    2001
_chemical_formula_sum            'Ag In S2'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.9972
_cell_length_b                   8.2733
_cell_length_c                   6.6939
_cell_volume                     387.509
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            silver1-2_344.cif
_cod_data_source_block           Ag1In1S2
_cod_original_cell_volume        387.5095
_cod_original_formula_sum        'Ag1 In1 S2'
_cod_database_code               1509403
X-ray study of the thermal expansion anisotropy in Ag Ga S2 and Ag In S2 compounds over the temperature range from 80 to 650 K
Orlova, N.S.; Bodnar', I.V.; Physica Status Solidi, Sectio A: Applied Research 91 (1985) 503–507; doi:10.1002/pssa.2210910218

data_1509404
_publ_section_title
;
 X-ray study of the thermal expansion anisotropy in Ag Ga S2 and Ag In S2
 compounds over the temperature range from 80 to 650 K
;
_journal_name_full
'Physica Status Solidi, Sectio A: Applied Research'
_journal_page_first              503
_journal_page_last               507
_journal_paper_doi               10.1002/pssa.2210910218
_journal_volume                  91
_journal_year                    1985
_chemical_formula_sum            'Ag In S2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.8288
_cell_length_b                   5.8288
_cell_length_c                   11.1975
_cell_volume                     380.434
_citation_journal_id_ASTM        PSSABA
_cod_data_source_file            silver1-2_345.cif
_cod_data_source_block           Ag1In1S2
_cod_original_cell_volume        380.4341
_cod_original_formula_sum        'Ag1 In1 S2'
_cod_database_code               1509404
Ueber einige quaternaere Chalkogenide mit Spinellstruktur
Eulenberger, G.; Strick, G.; Hahn, H.; Zeitschrift fuer Anorganische und Allgemeine Chemie 357 (1968) 338–344; doi:10.1002/zaac.19683570421

data_1509405
_publ_section_title
;
 Ueber einige quaternaere Chalkogenide mit Spinellstruktur
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              338
_journal_page_last               344
_journal_paper_doi               10.1002/zaac.19683570421
_journal_volume                  357
_journal_year                    1968
_chemical_formula_sum            'Ag In S4 Sn'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   10.74
_cell_length_b                   10.74
_cell_length_c                   10.74
_cell_volume                     1238.833
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            silver1-2_346.cif
_cod_data_source_block           Ag1In1S4Sn1
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_original_formula_sum        'Ag1 In1 S4 Sn1'
_cod_database_code               1509405
Pressure induced phase transformations in some I-III-IV2 semiconductors
Kasper, H.M.; Jayaraman, A.; Dernier, P.D.; Maines, R.G.; High Temperatures-High Pressures 9 (1977) 97–102; doi:

data_1509406
_publ_section_title
;
 Pressure induced phase transformations in some I-III-IV2 semiconductors
;
_journal_name_full               'High Temperatures-High Pressures'
_journal_page_first              97
_journal_page_last               102
_journal_volume                  9
_journal_year                    1977
_chemical_formula_sum            'Ag In Se2'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.6
_cell_length_b                   5.6
_cell_length_c                   5.6
_cell_volume                     175.616
_citation_journal_id_ASTM        HTHPAK
_cod_data_source_file            silver1-2_347.cif
_cod_data_source_block           Ag1In1Se2
_cod_original_formula_sum        'Ag1 In1 Se2'
_cod_database_code               1509406
Compressibility and phase transformations of Ag In Se2 from high-pressure X-ray diffraction studies
Turtsevich, G.A.; Bodnar', I.V.; Orlova, N.S.; Inorganic Materials (USSR) (see: Izv.Akad.Nauk, Neorg.Mater.) 30 (1994) 696–700; doi:

data_1509407
_publ_section_title
;
 Compressibility and phase transformations of Ag In Se2 from high-pressure
 X-ray diffraction studies
;
_journal_name_full
;
Inorganic Materials (USSR) (see: Izv.Akad.Nauk, Neorg.Mater.)
;
_journal_page_first              696
_journal_page_last               700
_journal_volume                  30
_journal_year                    1994
_chemical_formula_sum            'Ag In Se2'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.775
_cell_length_b                   5.775
_cell_length_c                   5.775
_cell_volume                     192.600
_citation_journal_id_ASTM        INOMAF
_cod_data_source_file            silver1-2_349.cif
_cod_data_source_block           Ag1In1Se2
_cod_original_cell_volume        192.5999
_cod_original_formula_sum        'Ag1 In1 Se2'
_cod_database_code               1509407
Cu Ga Se2 and Ag In Se2: Preparation and properties of single crystals
Lerner, L.S.; Journal of Physics and Chemistry of Solids 27 (1966) 1–8; doi:10.1016/0022-3697(66)90157-0

data_1509408
_publ_section_title
;
 Cu Ga Se2 and Ag In Se2: Preparation and properties of single crystals
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              1
_journal_page_last               8
_journal_paper_doi               10.1016/0022-3697(66)90157-0
_journal_volume                  27
_journal_year                    1966
_chemical_formula_sum            'Ag In Se2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.092
_cell_length_b                   6.092
_cell_length_c                   11.64
_cell_volume                     431.989
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            silver1-2_350.cif
_cod_data_source_block           Ag1In1Se2
_cod_original_cell_volume        431.9891
_cod_original_formula_sum        'Ag1 In1 Se2'
_cod_database_code               1509408
Ueber Hochdruckphasen des CuInSe2 und AgInSe2 mit dichter Zinkblendestruktur
Engels, J.; Weiss, A.; Range, K.J.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 23 (1968) 1262–1263; doi:

data_7209343
_publ_section_title
;
 Ueber Hochdruckphasen des CuInSe2 und AgInSe2 mit dichter
 Zinkblendestruktur
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (2,1947-32,1977)
;
_journal_page_first              1262
_journal_page_last               1263
_journal_volume                  23
_journal_year                    1968
_chemical_formula_sum            'Ag In Se2'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.82
_cell_length_b                   5.82
_cell_length_c                   5.82
_cell_volume                     197.137
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            silver1-2_351.cif
_cod_data_source_block           Ag1In1Se2
_cod_original_cell_volume        197.1374
_cod_original_formula_sum        'Ag1 In1 Se2'
_cod_database_code               7209343
Crystal structure of chalcopyrite Ag In Se2
Lesueur, R.; Djega-Mariadassou, C.; Benoit, P.; Charpin, P.; Japanese Journal of Applied Physics 19 (1980) 85–88; doi:

data_1509409
_publ_section_title
;
 Crystal structure of chalcopyrite Ag In Se2
;
_journal_name_full               'Japanese Journal of Applied Physics'
_journal_page_first              85
_journal_page_last               88
_journal_volume                  19
_journal_year                    1980
_chemical_formula_sum            'Ag In Se2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.1038
_cell_length_b                   6.1038
_cell_length_c                   11.7118
_cell_volume                     436.339
_citation_journal_id_ASTM        JJAPA5
_cod_data_source_file            silver1-2_352.cif
_cod_data_source_block           Ag1In1Se2
_cod_original_cell_volume        436.3392
_cod_original_formula_sum        'Ag1 In1 Se2'
_cod_database_code               1509409
Pressure-induced phase transformations in some I-III-IV2 semiconductors
Maines, R.G.; Jayaraman, A.; Dernier, P.D.; Kasper, H.M.; High Temperatures-High Pressures 9 (1977) 97–102; doi:

data_1509410
_publ_section_title
;
 Pressure-induced phase transformations in some I-III-IV2 semiconductors
;
_journal_name_full               'High Temperatures-High Pressures'
_journal_page_first              97
_journal_page_last               102
_journal_volume                  9
_journal_year                    1977
_chemical_formula_sum            'Ag In Te2'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.96
_cell_length_b                   5.96
_cell_length_c                   5.96
_cell_volume                     211.709
_citation_journal_id_ASTM        HTHPAK
_cod_data_source_file            silver1-2_353.cif
_cod_data_source_block           Ag1In1Te2
_cod_original_cell_volume        211.7087
_cod_original_formula_sum        'Ag1 In1 Te2'
_cod_database_code               1509410
High pressure transformations of ternary chalcogenides with cholcopyrite-structure. I. Indiem containing compounds
Weiss, A.; Range, K.J.; Engert, G.; Solid State Communications 7 (1969) 1749–1752; doi:10.1016/0038-1098(69)90277-4

data_1509411
_publ_section_title
;
 High pressure transformations of ternary chalcogenides with
 cholcopyrite-structure. I. Indiem containing compounds
;
_journal_name_full               'Solid State Communications'
_journal_page_first              1749
_journal_page_last               1752
_journal_paper_doi               10.1016/0038-1098(69)90277-4
_journal_volume                  7
_journal_year                    1969
_chemical_formula_sum            'Ag In Te2'
_space_group_IT_number           216
_symmetry_space_group_name_Hall  'F -4 2 3'
_symmetry_space_group_name_H-M   'F -4 3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.23
_cell_length_b                   6.23
_cell_length_c                   6.23
_cell_volume                     241.804
_citation_journal_id_ASTM        SSCOA4
_cod_data_source_file            silver1-2_354.cif
_cod_data_source_block           Ag1In1Te2
_cod_original_cell_volume        241.8044
_cod_original_formula_sum        'Ag1 In1 Te2'
_cod_database_code               1509411
Preparation and charecterization of the pseudobinary system Cu1-x Agx In Te2
Gopalam, B.S.V.; Krishna Rao, D.; Kasiviswanathan, S.; Journal of Materials Science. Letters 5 (1986) 912–914; doi:10.1007/BF01729272

data_1509412
_publ_section_title
;
 Preparation and charecterization of the pseudobinary system Cu1-x Agx In
 Te2
;
_journal_name_full               'Journal of Materials Science. Letters'
_journal_page_first              912
_journal_page_last               914
_journal_paper_doi               10.1007/BF01729272
_journal_volume                  5
_journal_year                    1986
_chemical_formula_sum            'Ag In Te2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.4672
_cell_length_b                   6.4672
_cell_length_c                   12.6331
_cell_volume                     528.375
_citation_journal_id_ASTM        JMSLD5
_cod_data_source_file            silver1-2_355.cif
_cod_data_source_block           Ag1In1Te2
_cod_original_cell_volume        528.3752
_cod_original_formula_sum        'Ag1 In1 Te2'
_cod_database_code               1509412
Ueber Hochdruckphasen des Ag In Te2 und Cu In Te2 mit Na Cl-Struktur
Engert, G.; Weiss, A.; Engels, J.; Range, K.J.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 23 (1968) 1008–1008; doi:

data_7209344
_publ_section_title
;
 Ueber Hochdruckphasen des Ag In Te2 und Cu In Te2 mit Na Cl-Struktur
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (2,1947-32,1977)
;
_journal_page_first              1008
_journal_page_last               1008
_journal_volume                  23
_journal_year                    1968
_chemical_formula_sum            'Ag In Te2'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.02
_cell_length_b                   6.02
_cell_length_c                   6.02
_cell_volume                     218.167
_citation_journal_id_ASTM        ZENBAX
_cod_data_source_file            silver1-2_357.cif
_cod_data_source_block           Ag1In1Te2
_cod_original_cell_volume        218.1672
_cod_original_formula_sum        'Ag1 In1 Te2'
_cod_database_code               7209344
Ueber einige ternaere Chalkogenide mit Chalkopyritstruktur
Meyer, A.D.; Klingler, W.; Stoerger, G.; Frank, G.; Hahn, H.; Zeitschrift fuer Anorganische und Allgemeine Chemie 271 (1953) 153–170; doi:10.1002/zaac.19532710307

data_1509413
_publ_section_title
;
 Ueber einige ternaere Chalkogenide mit Chalkopyritstruktur
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              153
_journal_page_last               170
_journal_paper_doi               10.1002/zaac.19532710307
_journal_volume                  271
_journal_year                    1953
_chemical_formula_sum            'Ag In Te2'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.406
_cell_length_b                   6.406
_cell_length_c                   12.56
_cell_volume                     515.423
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            silver1-2_358.cif
_cod_data_source_block           Ag1In1Te2
_cod_original_cell_volume        515.4227
_cod_original_formula_sum        'Ag1 In1 Te2'
_cod_database_code               1509413
Crystal structure refinement of Cux Ag1-x In Te2 bulk material determined from X-ray powder diffraction data using the Rietveld method
Moustafa, A.M.; El-Sayad, E.A.; Sakr, G.B.; Crystal Research and Technology 39 (2004) 266–273; doi:10.1002/crat.200310181

data_1509414
_publ_section_title
;
 Crystal structure refinement of Cux Ag1-x In Te2 bulk material determined
 from X-ray powder diffraction data using the Rietveld method
;
_journal_name_full               'Crystal Research and Technology'
_journal_page_first              266
_journal_page_last               273
_journal_paper_doi               10.1002/crat.200310181
_journal_volume                  39
_journal_year                    2004
_chemical_formula_sum            'Ag In1.03 Te1.972'
_space_group_IT_number           122
_symmetry_space_group_name_Hall  'I -4 2bw'
_symmetry_space_group_name_H-M   'I -4 2 d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.44296
_cell_length_b                   6.44296
_cell_length_c                   12.63572
_cell_volume                     524.531
_citation_journal_id_ASTM        CRTEDF
_cod_data_source_file            silver1-2_359.cif
_cod_data_source_block           Ag1In1.03Te1.972
_cod_original_cell_volume        524.5306
_cod_original_formula_sum        'Ag1 In1.03 Te1.972'
_cod_database_code               1509414
Compounds and pseudo-binary alloys with the Cu Al2 (C16)-type structure. I. Preparation and X-ray results
Damsma, H.; Hokkeling, P.; Havinga, E.E.; Journal of the Less-Common Metals 27 (1972) 169–186; doi:10.1016/0022-5088(72)90028-8

data_1509415
_publ_section_title
;
 Compounds and pseudo-binary alloys with the Cu Al2 (C16)-type structure.
 I. Preparation and X-ray results
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              169
_journal_page_last               186
_journal_paper_doi               10.1016/0022-5088(72)90028-8
_journal_volume                  27
_journal_year                    1972
_chemical_formula_sum            'Ag In2'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.881
_cell_length_b                   6.881
_cell_length_c                   5.62
_cell_volume                     266.097
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            silver1-2_360.cif
_cod_data_source_block           Ag1In2
_cod_original_cell_volume        266.0966
_cod_original_formula_sum        'Ag1 In2'
_cod_database_code               1509415
Das Zweistoffsystem Silber-Indium
Hellner, E.; Zeitschrift fuer Metallkunde 42 (1951) 17–19; doi:

data_1509416
_publ_section_title
;
 Das Zweistoffsystem Silber-Indium
;
_journal_name_full               'Zeitschrift fuer Metallkunde'
_journal_page_first              17
_journal_page_last               19
_journal_volume                  42
_journal_year                    1951
_chemical_formula_sum            'Ag In2'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.869
_cell_length_b                   6.869
_cell_length_c                   5.604
_cell_volume                     264.414
_citation_journal_id_ASTM        ZEMTAE
_cod_data_source_file            silver1-2_361.cif
_cod_data_source_block           Ag1In2
_cod_original_cell_volume        264.4144
_cod_original_formula_sum        'Ag1 In2'
_cod_database_code               1509416