#------------------------------------------------------------------------------ #$Date: 2023-03-24 18:37:27 +0200 (Fri, 24 Mar 2023) $ #$Revision: 282053 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/20/9012001.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9012001 loop_ _publ_author_name 'Straumanis, M. E.' _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 loop_ _space_group_symop_operation_xyz x,y,z -x,-x+y,1/2+z x,x-y,1/2-z -x+y,-x,1/2-z x-y,x,1/2+z -y,-x,z y,x,-z y,-x+y,-z -y,x-y,z x-y,-y,1/2+z -x+y,y,1/2-z x,y,1/2-z -x,-y,1/2+z x,x-y,z -x,-x+y,-z x-y,x,-z -x+y,-x,z y,x,1/2+z -y,-x,1/2-z -y,x-y,1/2-z y,-x+y,1/2+z -x+y,y,z x-y,-y,-z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Mg 0.33333 0.66667 0.25000 loop_ _cod_related_entry_id _cod_related_entry_database _cod_related_entry_code 1 ChemSpider 4575328 2 AMCSD 0012871