LMucko/crystallography-open-database huggingface dataset:
Characterization of lattice strain induced by neutron irradiation Sample: Unirradiated
Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C.; Physics and Chemistry of Minerals 22 (1995) 399–405; doi:

data_9006346
_publ_section_title
;
 Characterization of lattice strain induced by neutron irradiation
 Sample: Unirradiated
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              399
_journal_page_last               405
_journal_volume                  22
_journal_year                    1995
_chemical_formula_sum            'Al K O8 Si3'
_chemical_name_mineral           Orthoclase
_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                 116.026
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.58804
_cell_length_b                   13.00492
_cell_length_c                   7.19238
_cell_volume                     721.836
_database_code_amcsd             0007928
_exptl_crystal_density_diffrn    2.561
_cod_original_formula_sum        'K Al Si3 O8'
_cod_database_code               9006346
Characterization of lattice strain induced by neutron irradiation Sample: neutron dose = 6.3*10^18 n/cm2
Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C.; Physics and Chemistry of Minerals 22 (1995) 399–405; doi:

data_9006347
_publ_section_title
;
 Characterization of lattice strain induced by neutron irradiation
 Sample: neutron dose = 6.3*10^18 n/cm2
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              399
_journal_page_last               405
_journal_volume                  22
_journal_year                    1995
_chemical_formula_sum            'Al K O8 Si3'
_chemical_name_mineral           Orthoclase
_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                 116.009
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.59122
_cell_length_b                   13.00089
_cell_length_c                   7.19192
_cell_volume                     721.938
_database_code_amcsd             0007929
_exptl_crystal_density_diffrn    2.561
_cod_original_formula_sum        'K Al Si3 O8'
_cod_database_code               9006347
Characterization of lattice strain induced by neutron irradiation Sample: neutron dose = 1.26*10^19 n/cm2
Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C.; Physics and Chemistry of Minerals 22 (1995) 399–405; doi:

data_9006348
_publ_section_title
;
 Characterization of lattice strain induced by neutron irradiation
 Sample: neutron dose = 1.26*10^19 n/cm2
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              399
_journal_page_last               405
_journal_volume                  22
_journal_year                    1995
_chemical_formula_sum            'Al K O8 Si3'
_chemical_name_mineral           Orthoclase
_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                 115.990
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.59046
_cell_length_b                   12.99323
_cell_length_c                   7.18763
_cell_volume                     721.135
_database_code_amcsd             0007930
_exptl_crystal_density_diffrn    2.564
_cod_original_formula_sum        'K Al Si3 O8'
_cod_database_code               9006348
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 1.000
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006349
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 1.000
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KCuF3
_chemical_formula_sum            'Cu F3 K'
_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_length_a                   5.8604
_cell_length_b                   5.8604
_cell_length_c                   7.8528
_cell_formula_units_Z            4
_cell_volume                     269.699
_database_code_amcsd             0007931
_exptl_crystal_density_diffrn    3.932
_cod_original_formula_sum        'K Cu F3'
_cod_database_code               9006349
_amcsd_formula_title             KCuF3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.950
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006350
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.950
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.05Cu.95F3
_chemical_formula_sum            'Cu0.95 F3 K Mg0.05'
_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_length_a                   5.8564
_cell_length_b                   5.8564
_cell_length_c                   7.8555
_cell_formula_units_Z            4
_cell_volume                     269.423
_database_code_amcsd             0007932
_exptl_crystal_density_diffrn    3.887
_cod_original_formula_sum        'K (Cu.95 Mg.05) F3'
_cod_database_code               9006350
_amcsd_formula_title             KMg.05Cu.95F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.900
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006351
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.900
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.10Cu.90F3
_chemical_formula_sum            'Cu0.9 F3 K Mg0.1'
_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_length_a                   5.8488
_cell_length_b                   5.8488
_cell_length_c                   7.8585
_cell_formula_units_Z            4
_cell_volume                     268.827
_database_code_amcsd             0007933
_exptl_crystal_density_diffrn    3.847
_cod_original_formula_sum        'K (Cu.9 Mg.1) F3'
_cod_database_code               9006351
_amcsd_formula_title             KMg.10Cu.90F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.850
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006352
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.850
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.15Cu.85F3
_chemical_formula_sum            'Cu0.85 F3 K Mg0.15'
_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_length_a                   5.8423
_cell_length_b                   5.8423
_cell_length_c                   7.8647
_cell_formula_units_Z            4
_cell_volume                     268.442
_database_code_amcsd             0007934
_exptl_crystal_density_diffrn    3.804
_cod_original_formula_sum        'K (Cu.85 Mg.15) F3'
_cod_database_code               9006352
_amcsd_formula_title             KMg.15Cu.85F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.800
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006353
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.800
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.20Cu.80F3
_chemical_formula_sum            'Cu0.8 F3 K Mg0.2'
_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_length_a                   5.8311
_cell_length_b                   5.8311
_cell_length_c                   7.8746
_cell_formula_units_Z            4
_cell_volume                     267.750
_database_code_amcsd             0007935
_exptl_crystal_density_diffrn    3.766
_cod_original_formula_sum        'K (Cu.8 Mg.2) F3'
_cod_database_code               9006353
_amcsd_formula_title             KMg.20Cu.80F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.750
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006354
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.750
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.25Cu.75F3
_chemical_formula_sum            'Cu0.75 F3 K Mg0.25'
_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_length_a                   5.8149
_cell_length_b                   5.8149
_cell_length_c                   7.8863
_cell_formula_units_Z            4
_cell_volume                     266.660
_database_code_amcsd             0007936
_exptl_crystal_density_diffrn    3.732
_cod_original_formula_sum        'K (Cu.75 Mg.25) F3'
_cod_database_code               9006354
_amcsd_formula_title             KMg.25Cu.75F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.700
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006355
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.700
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.30Cu.70F3
_chemical_formula_sum            'Cu0.7 F3 K Mg0.3'
_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_length_a                   5.8018
_cell_length_b                   5.8018
_cell_length_c                   7.9006
_cell_formula_units_Z            4
_cell_volume                     265.941
_database_code_amcsd             0007937
_exptl_crystal_density_diffrn    3.693
_cod_original_formula_sum        'K (Cu.7 Mg.3) F3'
_cod_database_code               9006355
_amcsd_formula_title             KMg.30Cu.70F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.650
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006356
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.650
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.35Cu.65F3
_chemical_formula_sum            'Cu0.65 F3 K Mg0.35'
_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_length_a                   5.7746
_cell_length_b                   5.7746
_cell_length_c                   7.9245
_cell_formula_units_Z            4
_cell_volume                     264.250
_database_code_amcsd             0007938
_exptl_crystal_density_diffrn    3.667
_cod_original_formula_sum        'K (Cu.65 Mg.35) F3'
_cod_database_code               9006356
_amcsd_formula_title             KMg.35Cu.65F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.575
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006357
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.575
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.425Cu.575F3
_chemical_formula_sum            'Cu0.575 F3 K Mg0.425'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.0226
_cell_length_b                   4.0226
_cell_length_c                   4.0226
_cell_formula_units_Z            1
_cell_volume                     65.091
_database_code_amcsd             0007939
_exptl_crystal_density_diffrn    3.647
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.575 Mg.425) F3'
_cod_database_code               9006357
_amcsd_formula_title             KMg.425Cu.575F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.500
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006358
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.500
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.5Cu.5F3
_chemical_formula_sum            'Cu0.5 F3 K Mg0.5'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.0112
_cell_length_b                   4.0112
_cell_length_c                   4.0112
_cell_formula_units_Z            1
_cell_volume                     64.539
_database_code_amcsd             0007940
_exptl_crystal_density_diffrn    3.603
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.5 Mg.5) F3'
_cod_database_code               9006358
_amcsd_formula_title             KMg.5Cu.5F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.400
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006359
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.400
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.6Cu.4F3
_chemical_formula_sum            'Cu0.4 F3 K Mg0.6'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.0068
_cell_length_b                   4.0068
_cell_length_c                   4.0068
_cell_formula_units_Z            1
_cell_volume                     64.327
_database_code_amcsd             0007941
_exptl_crystal_density_diffrn    3.513
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.4 Mg.6) F3'
_cod_database_code               9006359
_amcsd_formula_title             KMg.6Cu.4F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.300
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006360
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.300
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.7Cu.3F3
_chemical_formula_sum            'Cu0.3 F3 K Mg0.7'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.9987
_cell_length_b                   3.9987
_cell_length_c                   3.9987
_cell_formula_units_Z            1
_cell_volume                     63.938
_database_code_amcsd             0007942
_exptl_crystal_density_diffrn    3.433
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.3 Mg.7) F3'
_cod_database_code               9006360
_amcsd_formula_title             KMg.7Cu.3F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.200
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006361
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.200
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.8Cu.2F3
_chemical_formula_sum            'Cu0.2 F3 K Mg0.8'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.9978
_cell_length_b                   3.9978
_cell_length_c                   3.9978
_cell_formula_units_Z            1
_cell_volume                     63.894
_database_code_amcsd             0007943
_exptl_crystal_density_diffrn    3.333
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.2 Mg.8) F3'
_cod_database_code               9006361
_amcsd_formula_title             KMg.8Cu.2F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.100
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006362
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.100
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMg.9Cu.1F3
_chemical_formula_sum            'Cu0.1 F3 K Mg0.9'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.9894
_cell_length_b                   3.9894
_cell_length_c                   3.9894
_cell_formula_units_Z            1
_cell_volume                     63.493
_database_code_amcsd             0007944
_exptl_crystal_density_diffrn    3.251
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K (Cu.1 Mg.9) F3'
_cod_database_code               9006362
_amcsd_formula_title             KMg.9Cu.1F3
A structural phase-transition in K(Mg1-xCux)F3 perovskite Sample: x = 0.000
Burns, P. C.; Hawthorne, F. C.; Hofmeister, A. M.; Moret, S. L.; Physics and Chemistry of Minerals 23 (1996) 141–150; doi:

data_9006363
_publ_section_title
;
 A structural phase-transition in K(Mg1-xCux)F3 perovskite
 Sample: x = 0.000
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              141
_journal_page_last               150
_journal_volume                  23
_journal_year                    1996
_chemical_formula_structural     KMgF3
_chemical_formula_sum            'F3 K Mg'
_space_group_IT_number           221
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.9859
_cell_length_b                   3.9859
_cell_length_c                   3.9859
_cell_formula_units_Z            1
_cell_volume                     63.326
_database_code_amcsd             0007945
_exptl_crystal_density_diffrn    3.157
_cod_original_sg_symbol_H-M      'P m 3 m'
_cod_original_formula_sum        'K Mg F3'
_cod_database_code               9006363
_amcsd_formula_title             KMgF3