LMucko/crystallography-open-database huggingface dataset:
Determination and Rietveld refinement of the crystal structure of Li0.5 Ni0.25 Ti O (P O4) from powder X-ray and neutron diffraction
Manoun, B.; El Jazouli, A.; Gravereau, P.; Bouree, F.; Chaminade, J.P.; Powder Diffraction 17 (2002) 290–294; doi:

data_1532846
_publ_section_title
;
 Determination and Rietveld refinement of the crystal structure of Li0.5
 Ni0.25 Ti O (P O4) from powder X-ray and neutron diffraction
;
_journal_name_full               'Powder Diffraction'
_journal_page_first              290
_journal_page_last               294
_journal_volume                  17
_journal_year                    2002
_chemical_formula_sum            'Li0.5 Ni0.25 O5 P Ti'
_chemical_name_systematic        'Li0.5 Ni0.25 (Ti O) (P O4)'
_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                 90.234
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.3906
_cell_length_b                   7.2568
_cell_length_c                   7.3673
_cell_volume                     341.658
_citation_journal_id_ASTM        PODIE2
_cod_data_source_file            Manoun_PODIE2_2002_598.cif
_cod_data_source_block           Li0.5Ni0.25O5P1Ti1
_cod_original_formula_sum        'Li0.5 Ni0.25 O5 P1 Ti1'
_cod_database_code               1532846
Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
Margadonna, S.; Pissas, M.; Prassides, K.; Arvanitidis, I.; Papavassiliou, M.; Fitch, A.N.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014518-1–014518-5; doi:

data_1532847
_publ_section_title
;
 Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              014518-1
_journal_page_last               014518-5
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'Al0.48 B2.2 Mg0.52'
_chemical_name_systematic        '(Mg0.52 Al0.48) B2.2'
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   3.04436
_cell_length_b                   3.04436
_cell_length_c                   6.71248
_cell_volume                     53.877
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Margadonna_PRBMDO_2002_21.cif
_cod_data_source_block           Al0.48B2.2Mg0.52
_cod_original_cell_volume        53.87728
_cod_database_code               1532847
Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
Margadonna, S.; Prassides, K.; Arvanitidis, I.; Pissas, M.; Fitch, A.N.; Papavassiliou, M.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014518-1–014518-5; doi:

data_1532848
_publ_section_title
;
 Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              014518-1
_journal_page_last               014518-5
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'Al0.45 B2 Mg0.56'
_chemical_name_systematic        'Mg0.51 (Mg0.05 Al0.45) B2'
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   3.04988
_cell_length_b                   3.04988
_cell_length_c                   6.7319
_cell_volume                     54.229
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Margadonna_PRBMDO_2002_22.cif
_cod_data_source_block           Al0.45B2Mg0.56
_cod_original_cell_volume        54.22928
_cod_database_code               1532848
Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
Margadonna, S.; Prassides, K.; Papavassiliou, M.; Pissas, M.; Arvanitidis, I.; Fitch, A.N.; Physical Review, Serie 3. B - Condensed Matter (18,1978-) 66 (2002) 014518-1–014518-5; doi:

data_1532849
_publ_section_title
;
 Crystal structure of the Mg1-x Alx B2 superconductors near x = 0.5
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              014518-1
_journal_page_last               014518-5
_journal_volume                  66
_journal_year                    2002
_chemical_formula_sum            'Al0.4 B2 Mg0.6'
_chemical_name_systematic        '(Mg0.6 Al0.4) B2'
_space_group_IT_number           191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.05473
_cell_length_b                   3.05473
_cell_length_c                   3.37686
_cell_volume                     27.289
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Margadonna_PRBMDO_2002_23.cif
_cod_data_source_block           Al0.4B2Mg0.6
_cod_original_cell_volume        27.28911
_cod_database_code               1532849
X-ray powder diffraction analysis of the heteropoly-molybdate (Mo O2)0.5 P Mo14 O42
Marosi, L.; Cifre, J.; Otero Arean, C.; Powder Diffraction 18 (2003) 236–239; doi:

data_1532850
_publ_section_title
;
 X-ray powder diffraction analysis of the heteropoly-molybdate (Mo O2)0.5
 P Mo14 O42
;
_journal_name_full               'Powder Diffraction'
_journal_page_first              236
_journal_page_last               239
_journal_volume                  18
_journal_year                    2003
_chemical_formula_sum            'Mo14.41 O42.82 P'
_chemical_name_systematic        '(Mo O2)0.41 (P Mo14 O42)'
_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                   11.795
_cell_length_b                   11.795
_cell_length_c                   11.795
_cell_volume                     1640.944
_citation_journal_id_ASTM        PODIE2
_cod_data_source_file            Marosi_PODIE2_2003_1968.cif
_cod_data_source_block           Mo14.41O42.82P1
_cod_original_formula_sum        'Mo14.41 O42.82 P1'
_cod_database_code               1532850
Synthesis, crystal and magnetic structure of the double perovskites A2 Ni Mo O6 (A = Sr, Ba): a neutron diffraction study
Martinez-Lope, M.J.; Alonso, J.A.; Casais, M.T.; European Journal of Inorganic Chemistry 2003 (2003) 2839–2844; doi:

data_4031530
_publ_section_title
;
 Synthesis, crystal and magnetic structure of the double perovskites A2 Ni
 Mo O6 (A = Sr, Ba): a neutron diffraction study
;
_journal_name_full               'European Journal of Inorganic Chemistry'
_journal_page_first              2839
_journal_page_last               2844
_journal_volume                  2003
_journal_year                    2003
_chemical_formula_sum            'Mo Ni O6 Sr2'
_chemical_name_systematic        'Sr2 Ni Mo O6'
_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            2
_cell_length_a                   5.54939
_cell_length_b                   5.54939
_cell_length_c                   7.89554
_cell_volume                     243.149
_citation_journal_id_ASTM        EJICFO
_cod_data_source_file            Martinez-Lope_EJICFO_2003_719.cif
_cod_data_source_block           Mo1Ni1O6Sr2
_cod_original_cell_volume        243.1489
_cod_original_formula_sum        'Mo1 Ni1 O6 Sr2'
_cod_database_code               4031530
Synthesis, crystal and magnetic structureof the double perovskites A2 Ni Mo O6 (A = Sr, Ba): a neutron diffraction study
Martinez-Lope, M.J.; Alonso, J.A.; Casais, M.T.; European Journal of Inorganic Chemistry 2003 (2003) 2839–2844; doi:

data_4031531
_publ_section_title
;
 Synthesis, crystal and magnetic structureof the double perovskites A2 Ni
 Mo O6 (A = Sr, Ba): a neutron diffraction study
;
_journal_name_full               'European Journal of Inorganic Chemistry'
_journal_page_first              2839
_journal_page_last               2844
_journal_volume                  2003
_journal_year                    2003
_chemical_formula_sum            'Ba2 Mo Ni O6'
_chemical_name_systematic        'Ba2 Ni Mo O6'
_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                   8.04862
_cell_length_b                   8.04862
_cell_length_c                   8.04862
_cell_volume                     521.392
_citation_journal_id_ASTM        EJICFO
_cod_data_source_file            Martinez-Lope_EJICFO_2003_720.cif
_cod_data_source_block           Ba2Mo1Ni1O6
_cod_original_cell_volume        521.3919
_cod_original_formula_sum        'Ba2 Mo1 Ni1 O6'
_cod_database_code               4031531
Preparation, crystal and magnetic structure of the double perovskites Ca2 T W O6 (T = Co, Ni)
Martinez-Lope, M.J.; Casais, M.T.; Alonso, J.A.; Fernandez-Diaz, M.T.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 58 (2003) 127–132; doi:

data_7222332
_publ_section_title
;
 Preparation, crystal and magnetic structure of the double perovskites Ca2
 T W O6 (T = Co, Ni)
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              127
_journal_page_last               132
_journal_volume                  58
_journal_year                    2003
_chemical_formula_sum            'Ca2 Co O6 W'
_chemical_name_systematic        'Ca2 (Co W O6)'
_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                 90.245
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.42475
_cell_length_b                   5.57959
_cell_length_c                   7.7134
_cell_volume                     233.466
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Martinez-Lope_ZNBSEN_2003_1154.cif
_cod_data_source_block           Ca2Co1O6W1
_cod_original_cell_volume        233.4661
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Ca2 Co1 O6 W1'
_cod_database_code               7222332
Preparation, crystal and magnetic structure of the double perovskites Ca2 T W O6 (T = Co, Ni)
Martinez-Lope, M.J.; Casais, M.T.; Alonso, J.A.; Fernandez-Diaz, M.T.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 58 (2003) 127–132; doi:

data_7222333
_publ_section_title
;
 Preparation, crystal and magnetic structure of the double perovskites Ca2
 T W O6 (T = Co, Ni)
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              127
_journal_page_last               132
_journal_volume                  58
_journal_year                    2003
_chemical_formula_sum            'Ca2 Ni O6 W'
_chemical_name_systematic        'Ca2 (Ni W O6)'
_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                 90.246
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.4048
_cell_length_b                   5.5369
_cell_length_c                   7.6889
_cell_volume                     230.095
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Martinez-Lope_ZNBSEN_2003_1155.cif
_cod_data_source_block           Ca2Ni1O6W1
_cod_original_cell_volume        230.0947
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Ca2 Ni1 O6 W1'
_cod_database_code               7222333
Synthesis, crystal and magnetic structure of the new double perovskite Ba2 Mn Mo O6
Martinez-Lope, M.J.; Alonso, J.A.; Casais, M.T.; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 58 (2003) 571–576; doi:

data_7222334
_publ_section_title
;
 Synthesis, crystal and magnetic structure of the new double perovskite
 Ba2 Mn Mo O6
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              571
_journal_page_last               576
_journal_volume                  58
_journal_year                    2003
_chemical_formula_sum            'Ba2 Mn Mo O6'
_chemical_name_systematic        'Ba2 (Mn Mo O6)'
_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                   8.18166
_cell_length_b                   8.18166
_cell_length_c                   8.18166
_cell_volume                     547.677
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Martinez-Lope_ZNBSEN_2003_1159.cif
_cod_data_source_block           Ba2Mn1Mo1O6
_cod_original_cell_volume        547.6766
_cod_original_formula_sum        'Ba2 Mn1 Mo1 O6'
_cod_database_code               7222334
Crystal structure of zeolite omega, the synthetic counterpart of the natural zeolite mazzite
Martucci, A.; Alberti, A.; Guzman-Castillo, M.L.; di Renzo, F.; Fajula, F.; Microporous and Mesoporous Materials 63 (2003) 33–42; doi:

data_1532851
_publ_section_title
;
 Crystal structure of zeolite omega, the synthetic counterpart of the
 natural zeolite mazzite
;
_journal_name_full               'Microporous and Mesoporous Materials'
_journal_page_first              33
_journal_page_last               42
_journal_volume                  63
_journal_year                    2003
_chemical_formula_sum
'C7.76 H73.2 Al8.4 N1.94 Na6.04 O96.96 Si27.6'
_chemical_name_systematic
;
(Na6.04 (H2 O)24.96) (N (C H3)4)1.94 (Al8.4 Si27.6 O72)
;
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   18.215
_cell_length_b                   18.215
_cell_length_c                   7.634
_cell_volume                     2193.518
_citation_journal_id_ASTM        MIMMFJ
_cod_data_source_file            Martucci_MIMMFJ_2003_856.cif
_cod_data_source_block           C7.76H73.2Al8.4N1.94Na6.04O96.96Si27.6
_cod_database_code               1532851
Relations of crystal structure to magnetic properties in the quasi-one-dimensional compound Pb Ni1.88 Mg0.12 V2 O8
Mastoraki, I.; Lappas, A.; Toebbens, D.M.; Giapintzakis, J.; Hernandez-Velasco, J.; Journal of Solid State Chemistry 177 (2004) 2404–2414; doi:

data_1532852
_publ_section_title
;
 Relations of crystal structure to magnetic properties in the
 quasi-one-dimensional compound Pb Ni1.88 Mg0.12 V2 O8
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2404
_journal_page_last               2414
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Mg0.12 Ni1.88 O8 Pb V2'
_chemical_name_systematic        'Pb (Ni1.88 Mg0.12) (V O4)2'
_space_group_IT_number           110
_symmetry_space_group_name_Hall  'I 4bw -2c'
_symmetry_space_group_name_H-M   'I 41 c d'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.25008
_cell_length_b                   12.25008
_cell_length_c                   8.35891
_cell_volume                     1254.375
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Mastoraki_JSSCBI_2004_1771.cif
_cod_data_source_block           Mg0.12Ni1.88O8Pb1V2
_cod_original_formula_sum        'Mg0.12 Ni1.88 O8 Pb1 V2'
_cod_database_code               1532852
A novel germanate, Cu2 Fe2 Ge4 O13, with a four tetrahedra oligomer
Masuda, T.; Chakoumakos, B.C.; Nygren, C.L.; Imai, S.; Uchinokura, K.; Journal of Solid State Chemistry 176 (2003) 175–179; doi:

data_1532853
_publ_section_title
;
 A novel germanate, Cu2 Fe2 Ge4 O13, with a four tetrahedra oligomer
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              175
_journal_page_last               179
_journal_volume                  176
_journal_year                    2003
_chemical_formula_sum            'Cu2 Fe2 Ge4 O13'
_chemical_name_systematic        'Cu2 Fe2 (Ge4 O13)'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.145
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.105
_cell_length_b                   8.5073
_cell_length_c                   4.8736
_cell_volume                     499.004
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Masuda_JSSCBI_2003_226.cif
_cod_data_source_block           Cu2Fe2Ge4O13
_cod_original_cell_volume        499.0038
_cod_database_code               1532853
Potassicleakeite, a new amphibole from the Tanohata mine, Iwate prefecture, Japan
Matsubara, S.; Miyawaki, R.; Kurosawa, M.; Suzuki, Y.; Journal of Mineralogical and Petrological Sciences 97 (2002) 177–184; doi:

data_1532854
_publ_section_title
;
 Potassicleakeite, a new amphibole from the Tanohata mine, Iwate
 prefecture, Japan
;
_journal_name_full
'Journal of Mineralogical and Petrological Sciences'
_journal_page_first              177
_journal_page_last               184
_journal_volume                  97
_journal_year                    2002
_chemical_formula_sum
'Fe1.52 H2 K0.54 Li0.82 Mg1.53 Mn1.13 Na2.46 O24 Si8'
_chemical_name_systematic
;
(K0.54 Na0.46) Na2 (Mg1.05 Mn0.95) (Fe1.52 Mg0.48) (Li0.82 Mn0.18) Si8 O22 (O 
H)2
;
_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                 104.04
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.932
_cell_length_b                   18.003
_cell_length_c                   5.2893
_cell_volume                     917.505
_citation_journal_id_ASTM        JMPSCA
_cod_data_source_file            Matsubara_JMPSCA_2002_442.cif
_cod_data_source_block           H2Fe1.52K0.54Li0.82Mg1.53Mn1.13Na2.46O24Si8
_cod_original_cell_volume        917.5045
_cod_original_formula_sum
'H2 Fe1.52 K0.54 Li0.82 Mg1.53 Mn1.13 Na2.46 O24 Si8'
_cod_database_code               1532854
Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2 Si2
Matsuda, T.D.; Metoki, N.; Yamamoto, E.; Haga, Y.; Ikeda, S.; Kaneko, K.; Onuki, Y.; Journal of Physics: Condensed Matter 15 (2003) S2023–S2027; doi:

data_1532855
_publ_section_title
;
 Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2
 Si2
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              S2023
_journal_page_last               S2027
_journal_volume                  15
_journal_year                    2003
_chemical_formula_sum            'Cr2 Si2 U'
_chemical_name_systematic        'U Cr2 Si2'
_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                   3.913
_cell_length_b                   3.913
_cell_length_c                   10.507
_cell_volume                     160.879
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Matsuda_JCOMEL_2003_752.cif
_cod_data_source_block           Cr2Si2U1
_cod_original_cell_volume        160.8787
_cod_original_formula_sum        'Cr2 Si2 U1'
_cod_database_code               1532855
Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2 Si2
Matsuda, T.D.; Onuki, Y.; Metoki, N.; Ikeda, S.; Kaneko, K.; Haga, Y.; Yamamoto, E.; Journal of Physics: Condensed Matter 15 (2003) S2023–S2027; doi:

data_1532856
_publ_section_title
;
 Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2
 Si2
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              S2023
_journal_page_last               S2027
_journal_volume                  15
_journal_year                    2003
_chemical_formula_sum            'Cr2 Si2 U'
_chemical_name_systematic        'U Cr2 Si2'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                91.49
_cell_angle_beta                 88.51
_cell_angle_gamma                90.74
_cell_formula_units_Z            2
_cell_length_a                   3.906
_cell_length_b                   3.903
_cell_length_c                   10.506
_cell_volume                     160.045
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Matsuda_JCOMEL_2003_753.cif
_cod_data_source_block           Cr2Si2U1
_cod_original_cell_volume        160.0449
_cod_original_formula_sum        'Cr2 Si2 U1'
_cod_database_code               1532856
Synthesis, structure and electrochemical properties of layered material, Li2/3 (Mn1/3 Fe2/3) O2 with mixed stacking states
Matsumura, T.; Kanno, R.; Sonoyama, N.; Solid State Ionics 161 (2003) 31–39; doi:

data_1532857
_publ_section_title
;
 Synthesis, structure and electrochemical properties of layered material,
 Li2/3 (Mn1/3 Fe2/3) O2 with mixed stacking states
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              31
_journal_page_last               39
_journal_volume                  161
_journal_year                    2003
_chemical_formula_sum            'Fe0.667 Mn0.333 Na0.75 O2'
_chemical_name_systematic        'Na0.75 ((Mn0.333 Fe0.667) O2)'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   2.9375
_cell_length_b                   2.9375
_cell_length_c                   11.1974
_cell_volume                     83.677
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Matsumura_SSIOD3_2003_922.cif
_cod_data_source_block           Fe0.667Mn0.333Na0.75O2
_cod_original_cell_volume        83.67651
_cod_database_code               1532857