LMucko/crystallography-open-database huggingface dataset:
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532515
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N4 Si3'
_chemical_name_systematic        'Si3 N4'
_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_formula_units_Z            2
_cell_length_a                   7.5585
_cell_length_b                   7.5585
_cell_length_c                   2.8855
_cell_volume                     142.765
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1068.cif
_cod_data_source_block           N4Si3
_cod_original_cell_volume        142.7654
_cod_database_code               1532515
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532516
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N4 Si3'
_chemical_name_systematic        'Si3 N4'
_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                   7.6765
_cell_length_b                   7.6765
_cell_length_c                   7.6765
_cell_volume                     452.366
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1070.cif
_cod_data_source_block           N4Si3
_cod_original_cell_volume        452.3658
_cod_original_sg_symbol_Hall     '-F 4vw 2vw 3 (x+1/8,y+1/8,z+1/8)'
_cod_database_code               1532516
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532517
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N2 O Si2'
_chemical_name_systematic        'Si2 N2 O'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.9643
_cell_length_b                   5.5366
_cell_length_c                   4.8899
_cell_volume                     242.694
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1072.cif
_cod_data_source_block           N2O1Si2
_cod_original_cell_volume        242.6943
_cod_original_formula_sum        'N2 O1 Si2'
_cod_database_code               1532517
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532518
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N2 O Si2'
_chemical_name_systematic        'Si2 N2 O'
_space_group_IT_number           141
_symmetry_space_group_name_Hall  '-I 4bd 2'
_symmetry_space_group_name_H-M   'I 41/a m d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   5.4158
_cell_length_b                   5.4158
_cell_length_c                   23.0433
_cell_volume                     675.880
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1073.cif
_cod_data_source_block           N2O1Si2
_cod_original_cell_volume        675.8806
_cod_original_formula_sum        'N2 O1 Si2'
_cod_database_code               1532518
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532519
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N2 O Si2'
_chemical_name_systematic        'Si2 N2 O'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.002
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   9.36
_cell_length_b                   5.404
_cell_length_c                   13.2583
_cell_volume                     670.624
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1075.cif
_cod_data_source_block           N2O1Si2
_cod_original_cell_volume        670.6238
_cod_original_formula_sum        'N2 O1 Si2'
_cod_database_code               1532519
Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
Kroll, P.; Milko, M.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737–1750; doi:

data_1532520
_publ_section_title
;
 Theoretical investigation of the solid state reaction of silicon nitride
 and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1737
_journal_page_last               1750
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'N2 O Si2'
_chemical_name_systematic        'Si2 N2 O'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.13
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   8.049
_cell_length_b                   4.6095
_cell_length_c                   12.606
_cell_volume                     467.705
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kroll_ZAACAB_2003_1077.cif
_cod_data_source_block           N2O1Si2
_cod_original_cell_volume        467.7049
_cod_original_formula_sum        'N2 O1 Si2'
_cod_database_code               1532520
High-pressure structural study of phase-A, Mg7 Si2 H6 O14 using synchrotron radiation
Kudoh, Y.; Kuribayashi, T.; Kagi, H.; Sasaki, S.; Tanaka, M.; Journal of Physics: Condensed Matter 14 (2002) 10491–10495; doi:

data_1532521
_publ_section_title
;
 High-pressure structural study of phase-A, Mg7 Si2 H6 O14 using
 synchrotron radiation
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              10491
_journal_page_last               10495
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'H6 Mg7 O14 Si2'
_chemical_name_systematic        '(Mg2 (Si O4))2 (Mg (O H)2)3'
_space_group_IT_number           173
_symmetry_space_group_name_Hall  'P 6c'
_symmetry_space_group_name_H-M   'P 63'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.756
_cell_length_b                   7.756
_cell_length_c                   9.469
_cell_volume                     493.299
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Kudoh_JCOMEL_2002_359.cif
_cod_data_source_block           H6Mg7O14Si2
_cod_original_cell_volume        493.2991
_cod_database_code               1532521
Synthesis, structure solution, characterization and catalytic properties of TNU-10: a high-silica zeolite with the STI topology
Hong Suk Bong; Wright, P.A.; Lear, E.G.; Zhou Wuzong; Nam In-Sik; Cox, P.A.; Park Joo-Hyoung; Shin Chaeho; Journal of the American Chemical Society 126 (2004) 5817–5826; doi:

data_4124531
_publ_section_title
;
 Synthesis, structure solution, characterization and catalytic properties
 of TNU-10: a high-silica zeolite with the STI topology
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              5817
_journal_page_last               5826
_journal_volume                  126
_journal_year                    2004
_chemical_formula_sum            'O144 Si72'
_chemical_name_systematic        'Si72 O144'
_space_group_IT_number           69
_symmetry_space_group_name_Hall  '-F 2 2'
_symmetry_space_group_name_H-M   'F m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   13.533
_cell_length_b                   17.925
_cell_length_c                   17.651
_cell_volume                     4281.762
_citation_journal_id_ASTM        JACSAT
_cod_data_source_file            HongSukBong_JACSAT_2004_1318.cif
_cod_data_source_block           O144Si72
_cod_database_code               4124531
Crystal structure of the Pd(I) carbonyl chloride complex (N H4)2 (Pd2 Cl4 (C O)2)
Kulik, A.V.; Nefedov, S.E.; Temkin, O.N.; Bruk, L.G.; Aleksandrov, G.G.; Eremenko, I.L.; Doklady Akad. Nauk 383 (2002) 218–220; doi:

data_1532522
_publ_section_title
;
 Crystal structure of the Pd(I) carbonyl chloride complex (N H4)2 (Pd2 Cl4
 (C O)2)
;
_journal_name_full               'Doklady Akad. Nauk'
_journal_page_first              218
_journal_page_last               220
_journal_volume                  383
_journal_year                    2002
_chemical_formula_sum            'C2 H8 Cl4 N2 O2 Pd2'
_chemical_name_systematic        '(N H4)2 (Pd2 Cl4 (C O)2)'
_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                 96
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.03
_cell_length_b                   8.983
_cell_length_c                   14.553
_cell_volume                     523.954
_citation_journal_id_ASTM        DAKNEQ
_cod_data_source_file            Kulik_DAKNEQ_2002_329.cif
_cod_data_source_block           C2H8Cl4N2O2Pd2
_cod_original_cell_volume        523.9542
_cod_database_code               1532522
Einkristall-Synthese hochschmelzender Oxyde bei niederer Temperatur: gamma-(Li4 (Si O4)) - ohne Fehlordnung, isotyp mit Na4 (Sn O4). (Was heisst 'Isotypie'?)
Hoppe, R.; Bernet, K.; Moeller, A.; Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1285–1293; doi:

data_1532523
_publ_section_title
;
 Einkristall-Synthese hochschmelzender Oxyde bei niederer Temperatur:
 gamma-(Li4 (Si O4)) - ohne Fehlordnung, isotyp mit Na4 (Sn O4). (Was
 heisst 'Isotypie'?)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1285
_journal_page_last               1293
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'Li4 O4 Si'
_chemical_name_systematic        'Li4 (Si O4)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                124.15
_cell_angle_beta                 97.18
_cell_angle_gamma                100.26
_cell_formula_units_Z            2
_cell_length_a                   7.519
_cell_length_b                   5.648
_cell_length_c                   5.031
_cell_volume                     167.214
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hoppe_ZAACAB_2003_1052.cif
_cod_data_source_block           Li4O4Si1
_cod_original_cell_volume        167.2144
_cod_original_formula_sum        'Li4 O4 Si1'
_cod_database_code               1532523
Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
Aatiq, A.; Boukhari, A.; Materials Letters 58 (2004) 2406–2411; doi:

data_1532524
_publ_section_title
;
 Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2
 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
;
_journal_name_full               'Materials Letters'
_journal_page_first              2406
_journal_page_last               2411
_journal_volume                  58
_journal_year                    2004
_chemical_formula_sum            'Ca0.333 La0.667 O3 Ti0.667 Zn0.333'
_chemical_name_systematic        '(Ca0.333 La0.667) ((Zn0.333 Ti0.667) O3)'
_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_formula_units_Z            4
_cell_length_a                   5.5171
_cell_length_b                   5.5444
_cell_length_c                   7.8109
_cell_volume                     238.928
_citation_journal_id_ASTM        MLETDJ
_cod_data_source_file            Aatiq_MLETDJ_2004_1912.cif
_cod_data_source_block           Ca0.333La0.667O3Ti0.667Zn0.333
_cod_original_cell_volume        238.9277
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               1532524
Synthesis and crystal structure of hollandite-type K~x~Nb~y~Ti~8-y~O~16~ ( x ≤ 1.15, 0 ≤ y ≤ 1)
Kumada, N.; Takei, T.; Hirose, K.; Kinomura, N.; Journal of the Ceramic Society of Japan 111 (2003) 352–356; doi:10.2109/jcersj.111.352

data_1532525
_publ_section_title
;
 Synthesis and crystal structure of hollandite-type K~x~Nb~y~Ti~8-y~O~16~
 ( x &#x2264; 1.15, 0 &#x2264; y &#x2264; 1)
;
_journal_issue                   1293
_journal_name_full               'Journal of the Ceramic Society of Japan'
_journal_page_first              352
_journal_page_last               356
_journal_paper_doi               10.2109/jcersj.111.352
_journal_volume                  111
_journal_year                    2003
_chemical_formula_sum            'K1.15 Nb0.67 O16 Ti7.33'
_chemical_name_systematic        'K1.15 (Nb0.67 Ti7.33 O16)'
_space_group_IT_number           87
_symmetry_space_group_name_Hall  '-I 4'
_symmetry_space_group_name_H-M   'I 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.226
_cell_length_b                   10.226
_cell_length_c                   2.974
_cell_volume                     310.994
_citation_journal_id_ASTM        JCSJEW
_cod_data_source_file            Kumada_JCSJEW_2003_1559.cif
_cod_data_source_block           K1.15Nb0.67O16Ti7.33
_cod_original_cell_volume        310.9944
_cod_database_code               1532525
Crystal structure and physical properties of (Ti, Sc) Ni Sn and (Zr, Sc) Ni Sn solid solutions
Horyn, A.; Bodak, O.; Romaka, L.; Gorelenko, Yu.; Tkachuk, A.; Davydov, V.; Stadnyk, Yu.; Journal of Alloys Compd. 363 (2004) 10–14; doi:

data_1532526
_publ_section_title
;
 Crystal structure and physical properties of (Ti, Sc) Ni Sn and (Zr, Sc)
 Ni Sn solid solutions
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              10
_journal_page_last               14
_journal_volume                  363
_journal_year                    2004
_chemical_formula_sum            'Ni Sc0.05 Sn Ti0.95'
_chemical_name_systematic        '(Ti0.95 Sc0.05) Ni Sn'
_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            4
_cell_length_a                   5.958
_cell_length_b                   5.958
_cell_length_c                   5.958
_cell_volume                     211.496
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Horyn_JALCEU_2004_1321.cif
_cod_data_source_block           Ni1Sc0.05Sn1Ti0.95
_cod_original_cell_volume        211.4957
_cod_original_formula_sum        'Ni1 Sc0.05 Sn1 Ti0.95'
_cod_database_code               1532526
Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
Aatiq, A.; Boukhari, A.; Materials Letters 58 (2004) 2406–2411; doi:

data_1532527
_publ_section_title
;
 Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2
 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
;
_journal_name_full               'Materials Letters'
_journal_page_first              2406
_journal_page_last               2411
_journal_volume                  58
_journal_year                    2004
_chemical_formula_sum            'Ca0.333 O3 Pr0.667 Ti0.667 Zn0.333'
_chemical_name_systematic        '(Ca0.333 Pr0.667) ((Zn0.333 Ti0.667) O3)'
_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_formula_units_Z            4
_cell_length_a                   5.4524
_cell_length_b                   5.5807
_cell_length_c                   7.7559
_cell_volume                     235.998
_citation_journal_id_ASTM        MLETDJ
_cod_data_source_file            Aatiq_MLETDJ_2004_1914.cif
_cod_data_source_block           Ca0.333O3Pr0.667Ti0.667Zn0.333
_cod_original_cell_volume        235.9982
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               1532527
Synthesis, crystal structure and properties of superconducting and non-superconducting Ru Sr2 (Nd, Ce)2 Cu2 O10 phases
Kuz'micheva, G.M.; Khlybov, E.P.; Andreenko, A.S.; Kostyleva, I.E.; Esaulova, Yu.V.; Physica C (Amsterdam) 383 (2003) 315–322; doi:

data_1532528
_publ_section_title
;
 Synthesis, crystal structure and properties of superconducting and
 non-superconducting Ru Sr2 (Nd, Ce)2 Cu2 O10 phases
;
_journal_name_full               'Physica C (Amsterdam)'
_journal_page_first              315
_journal_page_last               322
_journal_volume                  383
_journal_year                    2003
_chemical_formula_sum            'Ce0.8 Cu2 Nd1.38 O10 Ru Sr1.82'
_chemical_name_systematic        'Ru (Sr1.82 Nd0.18) (Nd1.2 Ce0.8) Cu2 O10'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   3.848
_cell_length_b                   3.848
_cell_length_c                   28.382
_cell_volume                     420.255
_citation_journal_id_ASTM        PHYCE6
_cod_data_source_file            Kuzmicheva_PHYCE6_2003_586.cif
_cod_data_source_block           Ce0.8Cu2Nd1.38O10Ru1Sr1.82
_cod_original_cell_volume        420.2552
_cod_original_formula_sum        'Ce0.8 Cu2 Nd1.38 O10 Ru1 Sr1.82'
_cod_database_code               1532528
Crystal structure and physical properties of (Ti, Sc) Ni Sn and (Zr, Sc) Ni Sn solid solutions
Horyn, A.; Bodak, O.; Davydov, V.; Gorelenko, Yu.; Romaka, L.; Tkachuk, A.; Stadnyk, Yu.; Journal of Alloys Compd. 363 (2004) 10–14; doi:

data_1532529
_publ_section_title
;
 Crystal structure and physical properties of (Ti, Sc) Ni Sn and (Zr, Sc)
 Ni Sn solid solutions
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              10
_journal_page_last               14
_journal_volume                  363
_journal_year                    2004
_chemical_formula_sum            'Ni Sc0.2 Sn Ti0.8'
_chemical_name_systematic        '(Ti0.8 Sc0.2) Ni Sn'
_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            4
_cell_length_a                   5.993
_cell_length_b                   5.993
_cell_length_c                   5.993
_cell_volume                     215.245
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Horyn_JALCEU_2004_1322.cif
_cod_data_source_block           Ni1Sc0.2Sn1Ti0.8
_cod_original_cell_volume        215.2449
_cod_original_formula_sum        'Ni1 Sc0.2 Sn1 Ti0.8'
_cod_database_code               1532529
Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
Aatiq, A.; Boukhari, A.; Materials Letters 58 (2004) 2406–2411; doi:

data_1532530
_publ_section_title
;
 Synthesis and structural study of the new perovskite series Ca Ln2 Zn Ti2
 O9 ( = (Ca1/3 Ln2/3)A (Zn1/3 Ti2/3)B O3) (Ln = La, Pr, Nd, Eu)
;
_journal_name_full               'Materials Letters'
_journal_page_first              2406
_journal_page_last               2411
_journal_volume                  58
_journal_year                    2004
_chemical_formula_sum            'Ca0.333 Nd0.667 O3 Ti0.667 Zn0.333'
_chemical_name_systematic        '(Ca0.333 Nd0.667) ((Zn0.333 Ti0.667) O3)'
_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_formula_units_Z            4
_cell_length_a                   5.4498
_cell_length_b                   5.5675
_cell_length_c                   7.7496
_cell_volume                     235.137
_citation_journal_id_ASTM        MLETDJ
_cod_data_source_file            Aatiq_MLETDJ_2004_1915.cif
_cod_data_source_block           Ca0.333Nd0.667O3Ti0.667Zn0.333
_cod_original_cell_volume        235.1365
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_database_code               1532530