LMucko/crystallography-open-database huggingface dataset:
The precision determination of lattice constants by the powder and rotation crystal methods and applications Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012001
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Mg
_chemical_name_common            Magnesium
_chemical_name_mineral           Magnesium
_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                   3.2093
_cell_length_b                   3.2093
_cell_length_c                   5.2103
_cell_volume                     46.474
_database_code_amcsd             0012871
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    1.737
_cod_depositor_comments
;
 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_database_code               9012001
The precision determination of lattice constants by the powder and rotation crystal methods and applications Locality: synthetic Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012002
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Locality: synthetic
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_formula_sum            Al
_chemical_name_mineral           Aluminum
_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                   4.04961
_cell_length_b                   4.04961
_cell_length_c                   4.04961
_cell_volume                     66.411
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    2.715
_cod_depositor_comments
;
As pointed out by Prof. Dr. Klaus-Dieter Liss from Technion - Israel
Institute of Technology in his 2018-12-07 07:39 report, the cell
constants in this entry were actually recorded in kX units, not in \%A
units as the CIF standard mandates. To make data uniform and to match
the definition of the CIF _cell_length_* data items, all cell
constants were multiplied by the 1.00202 coefficient (taken from Wood,
E. A.  The Conversion Factor for kX Units to Angstr\"om Units Journal
of Applied Physics, AIP Publishing, 1947, 18, 929 DOI:
10.1063/1.1697570, https://doi.org/10.1063/1.1697570).

Saulius Gra\<zulis
2018-12-10

 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9012002
The precision determination of lattice constants by the powder and rotation crystal methods and applications Locality: synthetic Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012003
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Locality: synthetic
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_formula_sum            Al
_chemical_name_mineral           Aluminium
_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                   4.04961
_cell_length_b                   4.04961
_cell_length_c                   4.04961
_cell_volume                     66.411
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    2.715
_cod_depositor_comments
;
As pointed out by Prof. Dr. Klaus-Dieter Liss from Technion - Israel
Institute of Technology in his 2018-12-07 07:39 report, the cell
constants in this entry were actually recorded in kX units, not in \%A
units as the CIF standard mandates. To make data uniform and to match
the definition of the CIF _cell_length_* data items, all cell
constants were multiplied by the 1.00202 coefficient (taken from Wood,
E. A.  The Conversion Factor for kX Units to Angstr\"om Units Journal
of Applied Physics, AIP Publishing, 1947, 18, 929 DOI:
10.1063/1.1697570, https://doi.org/10.1063/1.1697570).

Saulius Gra\<zulis
2018-12-10

 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9012003
_cod_duplicate_entry 9012002
The precision determination of lattice constants by the powder and rotation crystal methods and applications Locality: synthetic Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012004
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Locality: synthetic
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_formula_sum            Pb
_chemical_name_mineral           Lead
_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                   4.95004
_cell_length_b                   4.95004
_cell_length_c                   4.95004
_cell_volume                     121.290
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    11.416
_cod_depositor_comments
;
As pointed out by Prof. Dr. Klaus-Dieter Liss from Technion - Israel
Institute of Technology in his 2018-12-07 07:39 report, the cell
constants in this entry were actually recorded in kX units, not in \%A
units as the CIF standard mandates. To make data uniform and to match
the definition of the CIF _cell_length_* data items, all cell
constants were multiplied by the 1.00202 coefficient (taken from Wood,
E. A.  The Conversion Factor for kX Units to Angstr\"om Units Journal
of Applied Physics, AIP Publishing, 1947, 18, 929 DOI:
10.1063/1.1697570, https://doi.org/10.1063/1.1697570).

Saulius Gra\<zulis
2018-12-10

 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9012004
The precision determination of lattice constants by the powder and rotation crystal methods and applications Locality: synthetic Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012005
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Locality: synthetic
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_formula_sum            Sn
_chemical_name_mineral           Tin
_space_group_IT_number           141
_symmetry_space_group_name_Hall  'I 4bw 2bw -1bw'
_symmetry_space_group_name_H-M   'I 41/a m d :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.83146
_cell_length_b                   5.83146
_cell_length_c                   3.18129
_cell_volume                     108.183
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    4.000
_cod_original_sg_symbol_H-M      'F m 3 m'
_cod_database_code               9012005
The precision determination of lattice constants by the powder and rotation crystal methods and applications Locality: synthetic Sample: at T = 25 C
Straumanis, M. E.; Journal of Applied Physics 20 (1949) 726–734; doi:10.1063/1.1698520

data_9012006
_publ_section_title
;
 The precision determination of lattice constants by the powder and rotation
 crystal methods and applications
 Locality: synthetic
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              726
_journal_page_last               734
_journal_paper_doi               10.1063/1.1698520
_journal_volume                  20
_journal_year                    1949
_chemical_formula_sum            Bi
_chemical_name_common            Bismuth
_chemical_name_mineral           Bismuth
_chemical_name_systematic        Bismuth
_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                   4.54590
_cell_length_b                   4.54590
_cell_length_c                   11.86225
_cell_volume                     212.294
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    7.488
_cod_depositor_comments
;
As pointed out by Prof. Dr. Klaus-Dieter Liss from Technion - Israel
Institute of Technology in his 2018-12-07 07:39 report, the cell
constants in this entry were actually recorded in kX units, not in \%A
units as the CIF standard mandates. To make data uniform and to match
the definition of the CIF _cell_length_* data items, all cell
constants were multiplied by the 1.00202 coefficient (taken from Wood,
E. A.  The Conversion Factor for kX Units to Angstr\"om Units Journal
of Applied Physics, AIP Publishing, 1947, 18, 929 DOI:
10.1063/1.1697570, https://doi.org/10.1063/1.1697570).

In addition, in the original entry the _cell_length_c was apparently
taken from the wrong row in the published table. This value was
corrected as well.

Saulius Gra\<zulis
2018-12-10

 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_database_code               9012006
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 24 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012007
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 24 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2858
_cell_length_b                   2.2858
_cell_length_c                   3.5842
_cell_formula_units_Z            2
_cell_volume                     16.218
_database_code_amcsd             0012877
_diffrn_ambient_temperature      297.15
_exptl_crystal_density_diffrn    1.845
_cod_database_code               9012007
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 25 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012008
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 25 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2858
_cell_length_b                   2.2858
_cell_length_c                   3.5843
_cell_formula_units_Z            2
_cell_volume                     16.219
_database_code_amcsd             0012878
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    1.845
_cod_database_code               9012008
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 26.5 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012009
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 26.5 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2858
_cell_length_b                   2.2858
_cell_length_c                   3.5843
_cell_formula_units_Z            2
_cell_volume                     16.219
_database_code_amcsd             0012879
_diffrn_ambient_temperature      299.65
_exptl_crystal_density_diffrn    1.845
_cod_database_code               9012009
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 74 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012010
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 74 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2871
_cell_length_b                   2.2871
_cell_length_c                   3.5860
_cell_formula_units_Z            2
_cell_volume                     16.245
_database_code_amcsd             0012880
_diffrn_ambient_temperature      347.15
_exptl_crystal_density_diffrn    1.842
_cod_database_code               9012010
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 95 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012011
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 95 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2875
_cell_length_b                   2.2875
_cell_length_c                   3.5865
_cell_formula_units_Z            2
_cell_volume                     16.253
_database_code_amcsd             0012881
_diffrn_ambient_temperature      368.15
_exptl_crystal_density_diffrn    1.842
_cod_database_code               9012011
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 147 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012012
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 147 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2900
_cell_length_b                   2.2900
_cell_length_c                   3.5890
_cell_formula_units_Z            2
_cell_volume                     16.300
_database_code_amcsd             0012882
_diffrn_ambient_temperature      420.15
_exptl_crystal_density_diffrn    1.836
_cod_database_code               9012012
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 215 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012013
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 215 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2923
_cell_length_b                   2.2923
_cell_length_c                   3.5918
_cell_formula_units_Z            2
_cell_volume                     16.345
_database_code_amcsd             0012883
_diffrn_ambient_temperature      488.15
_exptl_crystal_density_diffrn    1.831
_cod_database_code               9012013
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 239 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012014
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 239 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2932
_cell_length_b                   2.2932
_cell_length_c                   3.5930
_cell_formula_units_Z            2
_cell_volume                     16.363
_database_code_amcsd             0012884
_diffrn_ambient_temperature      512.15
_exptl_crystal_density_diffrn    1.829
_cod_database_code               9012014
A high temperature precision X-ray camera: some measurements of the thermal coefficients of expansion of beryllium Sample: at T = 293 C
Gordon, P.; Journal of Applied Physics 20 (1949) 908–917; doi:10.1063/1.1698252

data_9012015
_publ_section_title
;
 A high temperature precision X-ray camera: some measurements of the thermal
 coefficients of expansion of beryllium
 Sample: at T = 293 C
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              908
_journal_page_last               917
_journal_paper_doi               10.1063/1.1698252
_journal_volume                  20
_journal_year                    1949
_chemical_compound_source        Synthetic
_chemical_formula_sum            Be
_chemical_name_common            Beryllium
_chemical_name_mineral           Beryllium
_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_length_a                   2.2958
_cell_length_b                   2.2958
_cell_length_c                   3.5959
_cell_formula_units_Z            2
_cell_volume                     16.414
_database_code_amcsd             0012885
_diffrn_ambient_temperature      566.15
_exptl_crystal_density_diffrn    1.823
_cod_database_code               9012015