{"system":"PD-ZR","release":"v2026.10","phases":[{"id":"phase:pd-zr:bcc-a2","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"BCC_A2","status":"assigned","structure":{"structure_type":"st:a2-w-ci2","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"W","strukturbericht":"A2","pearson":"cI2","space_group":{"number":229,"symbol":"Im-3m"}},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:BCC_A2","namespace":"tdb","label":"BCC_A2","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:bcc-a2","namespace":"corpus","label":"phase:pd-zr:bcc-a2","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"BCC_A2","type_code":"%B","sublattices":[{"site_ratio":1.0,"constituents":["PD","ZR"]},{"site_ratio":3.0,"constituents":["VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":39,"line_end":39,"text":"PHASE BCC_A2 %B 2 1 3 !"},"constituent":{"line_start":40,"line_end":40,"text":"CONST BCC_A2 : PD ZR% : VA : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":90,"line_end":90,"text":"TYPE-DEF B GES AMEND_PHASE_DESCRIPTION @ MAGNETIC -1 0.4 !","type_code":"B","amends":"@"}]},"parsed":{"phase_name":"BCC_A2","type_code":"%B","type_codes":["%","B"],"n_sublattices":2,"site_ratios":[1,3],"constituents":[["PD","ZR%"],["VA"]],"major_constituents":[["ZR"],[]],"magnetic":{"type_code":"B","afm_factor":-1,"structure_fraction":0.4,"line":90},"disordered_part":null,"ordered_partner":null},"parameters":{"total":4,"by_kind":{"G":2,"L":2},"L_by_order":{"0":1,"1":1},"interaction_orders":[0,1],"endmember_G":2},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":1033.15,"T_max_K":3999.1,"x_min":0.88596,"x_max":1.0,"stable_at_top_of_range":true}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["BCC_A2"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:fcc-a1","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"FCC_A1","status":"assigned","structure":{"structure_type":"st:a1-cu-cf4","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"Cu","strukturbericht":"A1","pearson":"cF4","space_group":{"number":225,"symbol":"Fm-3m"}},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:FCC_A1","namespace":"tdb","label":"FCC_A1","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:fcc-a1","namespace":"corpus","label":"phase:pd-zr:fcc-a1","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"FCC_A1","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["PD","ZR"]},{"site_ratio":1.0,"constituents":["VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":34,"line_end":34,"text":"PHASE FCC_A1 %A 2 1 1 !"},"constituent":{"line_start":35,"line_end":35,"text":"CONST FCC_A1 : PD% ZR : VA : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":89,"line_end":89,"text":"TYPE-DEF A GES AMEND_PHASE_DESCRIPTION @ MAGNETIC -3 0.28 !","type_code":"A","amends":"@"}]},"parsed":{"phase_name":"FCC_A1","type_code":"%A","type_codes":["%","A"],"n_sublattices":2,"site_ratios":[1,1],"constituents":[["PD%","ZR"],["VA"]],"major_constituents":[["PD"],[]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":89},"disordered_part":null,"ordered_partner":null},"parameters":{"total":4,"by_kind":{"G":2,"L":2},"L_by_order":{"0":1,"1":1},"interaction_orders":[0,1],"endmember_G":2},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1852.81,"x_min":0.0,"x_max":0.13582,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["FCC_A1"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:hcp-a3","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"HCP_A3","status":"assigned","structure":{"structure_type":"st:a3-mg-hp2","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"Mg","strukturbericht":"A3","pearson":"hP2","space_group":{"number":194,"symbol":"P6_3/mmc"}},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:HCP_A3","namespace":"tdb","label":"HCP_A3","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:hcp-a3","namespace":"corpus","label":"phase:pd-zr:hcp-a3","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"HCP_A3","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["PD","ZR"]},{"site_ratio":0.5,"constituents":["VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":44,"line_end":44,"text":"PHASE HCP_A3 %A 2 1 0.5 !"},"constituent":{"line_start":45,"line_end":45,"text":"CONST HCP_A3 : PD ZR% : VA : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":89,"line_end":89,"text":"TYPE-DEF A GES AMEND_PHASE_DESCRIPTION @ MAGNETIC -3 0.28 !","type_code":"A","amends":"@"}]},"parsed":{"phase_name":"HCP_A3","type_code":"%A","type_codes":["%","A"],"n_sublattices":2,"site_ratios":[1,0.5],"constituents":[["PD","ZR%"],["VA"]],"major_constituents":[["ZR"],[]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":89},"disordered_part":null,"ordered_partner":null},"parameters":{"total":3,"by_kind":{"G":2,"L":1},"L_by_order":{"0":1},"interaction_orders":[0],"endmember_G":2},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1138.99,"x_min":0.9925,"x_max":1.0,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["HCP_A3"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:liquid","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"LIQUID","status":"assigned","structure":{"structure_type":"st:liquid","basis":"liquid","confidence":"high","label":"liquid","prototype":null,"strukturbericht":null,"pearson":null,"space_group":null},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:LIQUID","namespace":"tdb","label":"LIQUID","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:liquid","namespace":"corpus","label":"phase:pd-zr:liquid","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"LIQUID","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["PD","ZR"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":29,"line_end":29,"text":"PHASE LIQUID:L % 1 1 !"},"constituent":{"line_start":30,"line_end":30,"text":"CONST LIQUID:L : PD ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"LIQUID","type_code":"%","type_codes":["%"],"n_sublattices":1,"site_ratios":[1],"constituents":[["PD","ZR"]],"major_constituents":[[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":5,"by_kind":{"G":2,"L":3},"L_by_order":{"0":1,"1":1,"2":1},"interaction_orders":[0,1,2],"endmember_G":2},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":1342.47,"T_max_K":4000.0,"x_min":0.0,"x_max":1.0,"stable_at_top_of_range":true}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["LIQUID"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pd11zr9","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PD11ZR9","status":"assigned","structure":{"structure_type":"st:ni11zr9-tp44","basis":"assessment_declared","tier":"C","confidence":"assessor-stated","label":"assessment-declared (Hallstedt 2025, mmc2)","source":{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","table":"mmc2","rows":[{"actual":"Pd11Zr9","model":"Pd11Zr9","pearson":"tP44","phase_name":"PD11ZR9","prototype":"Ni11Zr9","space_group":{"number":83,"symbol":"P4/m"},"strukturbericht":null}]},"prototype":"Ni11Zr9","strukturbericht":null,"pearson":"tP44","space_group":{"number":83,"symbol":"P4/m"},"caveats":["not certain from the name or DFT alone (no_on_hull_entry_in_both, no_structure_token); structure as stated in the SGTE crystallographic table for this phase name and system"]},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:PD11ZR9","namespace":"tdb","label":"PD11ZR9","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pd11zr9","namespace":"corpus","label":"phase:pd-zr:pd11zr9","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PD11ZR9","type_code":"%","sublattices":[{"site_ratio":11.0,"constituents":["PD"]},{"site_ratio":9.0,"constituents":["ZR"]}],"stoichiometric":true,"composition":{"PD":0.55,"ZR":0.45},"tdb_definition":{"verbatim":{"phase":{"line_start":66,"line_end":66,"text":"PHASE PD11ZR9 % 2 11 9 !"},"constituent":{"line_start":67,"line_end":67,"text":"CONST PD11ZR9 : PD : ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PD11ZR9","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[11,9],"constituents":[["PD"],["ZR"]],"major_constituents":[[],[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":1,"by_kind":{"G":1},"L_by_order":{},"interaction_orders":[],"endmember_G":1},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype Ni11Zr9 (tP44, P4/m)"]}],"stoichiometry":{"PD":0.55,"ZR":0.45},"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1260.0,"x_min":0.45,"x_max":0.45,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PD11ZR9"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pd3zr-d024","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PD3ZR_D024","status":"assigned","structure":{"structure_type":"st:d0-24-ni3ti-hp16","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"Ni3Ti","strukturbericht":"D0_24","pearson":"hP16","space_group":{"number":194,"symbol":"P6_3/mmc"},"caveats":["partitioned order/disorder model in PdZr-03Du.tdb also describes the disordered state"]},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:PD3ZR_D024","namespace":"tdb","label":"PD3ZR_D024","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pd3zr-d024","namespace":"corpus","label":"phase:pd-zr:pd3zr-d024","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PD3ZR_D024","type_code":"%","sublattices":[{"site_ratio":3.0,"constituents":["PD","ZR"]},{"site_ratio":1.0,"constituents":["PD","ZR"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":49,"line_end":49,"text":"PHASE PD3ZR_D024 % 2 3 1 !"},"constituent":{"line_start":50,"line_end":50,"text":"CONST PD3ZR_D024 : PD% ZR : PD ZR% : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PD3ZR_D024","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[3,1],"constituents":[["PD%","ZR"],["PD","ZR%"]],"major_constituents":[["PD"],["ZR"]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":12,"by_kind":{"G":4,"L":8},"L_by_order":{"0":4,"1":4},"interaction_orders":[0,1],"endmember_G":4},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype Ni3Ti (hP16, P6_3/mmc)"]}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":2162.55,"x_min":0.18311,"x_max":0.27053,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PD3ZR_D024"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pd4zr3","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PD4ZR3","status":"assigned","structure":{"structure_type":"st:pd4pu3-hr14","basis":"assessment_declared","tier":"C","confidence":"assessor-stated","label":"assessment-declared (Hallstedt 2025, mmc2)","source":{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","table":"mmc2","rows":[{"actual":"Pd4Zr3","model":"Pd4Zr3","pearson":"hR14","phase_name":"PD4ZR3","prototype":"Pd4Pu3","space_group":{"number":148,"symbol":"R-3"},"strukturbericht":null}]},"prototype":"Pd4Pu3","strukturbericht":null,"pearson":"hR14","space_group":{"number":148,"symbol":"R-3"},"caveats":["not certain from the name or DFT alone (no_on_hull_entry_in_both, no_structure_token); structure as stated in the SGTE crystallographic table for this phase name and system"]},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:PD4ZR3","namespace":"tdb","label":"PD4ZR3","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pd4zr3","namespace":"corpus","label":"phase:pd-zr:pd4zr3","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PD4ZR3","type_code":"%","sublattices":[{"site_ratio":4.0,"constituents":["PD"]},{"site_ratio":3.0,"constituents":["ZR"]}],"stoichiometric":true,"composition":{"PD":0.5714285714285714,"ZR":0.42857142857142855},"tdb_definition":{"verbatim":{"phase":{"line_start":61,"line_end":61,"text":"PHASE PD4ZR3 % 2 4 3 !"},"constituent":{"line_start":62,"line_end":62,"text":"CONST PD4ZR3 : PD : ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PD4ZR3","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[4,3],"constituents":[["PD"],["ZR"]],"major_constituents":[[],[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":1,"by_kind":{"G":1},"L_by_order":{},"interaction_orders":[],"endmember_G":1},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype Pd4Pu3 (hR14, R-3)"]}],"stoichiometry":{"PD":0.5714285714285714,"ZR":0.42857142857142855},"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1673.01,"x_min":0.42857,"x_max":0.42857,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PD4ZR3"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pdzr-alpha","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PDZR_ALPHA","status":"needs_review","structure":null,"candidates":[{"source":"dft_mp","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":63,"symbol":"Cmcm"},"detail":"on-hull MP ZrPd at x(ZR)=0.5000","material_id":"mp-aaaaatzb"},{"source":"dft_oqmd","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":11,"symbol":"P21/m"},"detail":"on-hull OQMD Pd1 Zr1 at x(ZR)=0.5000","material_id":"oqmd-2170569"},{"source":"sgte_mmc2","structure_type":"st:pdzr-alpha","prototype":"(PdZr-alpha)","strukturbericht":null,"pearson":null,"space_group":null,"detail":"Hallstedt 2025 mmc2 row for PDZR_ALPHA: PdZr-alpha"}],"review_reasons":["no_structure_token","polymorph_family:other phases of this system have the same composition"],"names":[{"name":"tdb:PdZr-03Du.tdb:PDZR_ALPHA","namespace":"tdb","label":"PDZR_ALPHA","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pdzr-alpha","namespace":"corpus","label":"phase:pd-zr:pdzr-alpha","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PDZR_ALPHA","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["PD"]},{"site_ratio":1.0,"constituents":["ZR"]}],"stoichiometric":true,"composition":{"PD":0.5,"ZR":0.5},"tdb_definition":{"verbatim":{"phase":{"line_start":71,"line_end":71,"text":"PHASE PDZR_ALPHA % 2 1 1 !"},"constituent":{"line_start":72,"line_end":72,"text":"CONST PDZR_ALPHA : PD : ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PDZR_ALPHA","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,1],"constituents":[["PD"],["ZR"]],"major_constituents":[[],[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":1,"by_kind":{"G":1},"L_by_order":{},"interaction_orders":[],"endmember_G":1},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}}}],"stoichiometry":{"PD":0.5,"ZR":0.5},"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":469.39,"x_min":0.5,"x_max":0.5,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PDZR_ALPHA"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pdzr-b2","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PDZR_B2","status":"assigned","structure":{"structure_type":"st:b2-cscl-cp2","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"CsCl","strukturbericht":"B2","pearson":"cP2","space_group":{"number":221,"symbol":"Pm-3m"}},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:PDZR_B2","namespace":"tdb","label":"PDZR_B2","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pdzr-b2","namespace":"corpus","label":"phase:pd-zr:pdzr-b2","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PDZR_B2","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["PD","VA"]},{"site_ratio":1.0,"constituents":["PD","ZR"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":81,"line_end":81,"text":"PHASE PDZR_B2 % 2 1 1 !"},"constituent":{"line_start":82,"line_end":82,"text":"CONST PDZR_B2 : PD% VA : PD ZR% : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PDZR_B2","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,1],"constituents":[["PD%","VA"],["PD","ZR%"]],"major_constituents":[["PD"],["ZR"]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":10,"by_kind":{"G":4,"L":6},"L_by_order":{"0":4,"1":2},"interaction_orders":[0,1],"endmember_G":4},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype CsCl (cP2, Pm-3m)"]}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1872.83,"x_min":0.46881,"x_max":0.5944,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PDZR_B2"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pdzr-b33","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PDZR_B33","status":"assigned","structure":{"structure_type":"st:b33-crb-oc8","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"CrB","strukturbericht":"B33","pearson":"oC8","space_group":{"number":63,"symbol":"Cmcm"}},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:PdZr-03Du.tdb:PDZR_B33","namespace":"tdb","label":"PDZR_B33","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pdzr-b33","namespace":"corpus","label":"phase:pd-zr:pdzr-b33","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PDZR_B33","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["PD"]},{"site_ratio":1.0,"constituents":["ZR"]}],"stoichiometric":true,"composition":{"PD":0.5,"ZR":0.5},"tdb_definition":{"verbatim":{"phase":{"line_start":76,"line_end":76,"text":"PHASE PDZR_B33 % 2 1 1 !"},"constituent":{"line_start":77,"line_end":77,"text":"CONST PDZR_B33 : PD : ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PDZR_B33","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,1],"constituents":[["PD"],["ZR"]],"major_constituents":[[],[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":1,"by_kind":{"G":1},"L_by_order":{},"interaction_orders":[],"endmember_G":1},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype CrB (oC8, Cmcm)"]}],"stoichiometry":{"PD":0.5,"ZR":0.5},"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":469.39,"T_max_K":903.06,"x_min":0.5,"x_max":0.5,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PDZR_B33"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1},{"id":"phase:pd-zr:pdzrm","system":"PD-ZR","elements":["PD","ZR"],"preferred_name":"PDZRM","status":"needs_review","structure":null,"candidates":[{"source":"dft_mp","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":139,"symbol":"I4/mmm"},"detail":"on-hull MP Zr2Pd at x(ZR)=0.6667","material_id":"mp-aaaaaakg"},{"source":"dft_mp","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":63,"symbol":"Cmcm"},"detail":"on-hull MP ZrPd at x(ZR)=0.5000","material_id":"mp-aaaaatzb"},{"source":"dft_oqmd","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":11,"symbol":"P21/m"},"detail":"on-hull OQMD Pd1 Zr1 at x(ZR)=0.5000","material_id":"oqmd-2170569"},{"source":"dft_oqmd","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":99,"symbol":"P4mm"},"detail":"on-hull OQMD Pd1 Zr2 at x(ZR)=0.6667","material_id":"oqmd-1895338"},{"source":"dft_oqmd","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":64,"symbol":"Cmca"},"detail":"on-hull OQMD Pd10 Zr7 at x(ZR)=0.4118","material_id":"oqmd-2136798"},{"source":"sgte_mmc2","structure_type":"st:c11-b-mosi2-ti6","prototype":"MoSi2","strukturbericht":"C11_b","pearson":"tI6","space_group":{"number":139,"symbol":"I4/mmm"},"detail":"Hallstedt 2025 mmc2 row for PDZRM: Pd2Zr (see also CuZr2)"},{"source":"sgte_mmc2","structure_type":"st:cuzr2-ti6","prototype":"CuZr2","strukturbericht":null,"pearson":"tI6","space_group":{"number":139,"symbol":"I4/mmm"},"detail":"Hallstedt 2025 mmc2 row for PDZRM: PdZr2 (see also MoSi2)"},{"source":"tdb_comment","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":null,"detail":"PdZr-03Du.tdb: 'Prototype MoSi2, both Pd2Zr and PdZr2'"}],"review_reasons":["name_has_descriptive_tokens:PDZRM","no_structure_token","sgte_mmc2_rows_disagree"],"names":[{"name":"tdb:PdZr-03Du.tdb:PDZRM","namespace":"tdb","label":"PDZRM","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d"},{"name":"corpus:phase:pd-zr:pdzrm","namespace":"corpus","label":"phase:pd-zr:pdzrm","in_sgte_corpus":false}],"models":[{"tdb":"PdZr-03Du.tdb","path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","phase_name":"PDZRM","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["PD"]},{"site_ratio":1.0,"constituents":["ZR"]},{"site_ratio":1.0,"constituents":["PD","ZR"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":56,"line_end":56,"text":"PHASE PDZRM % 3 1 1 1 !"},"constituent":{"line_start":57,"line_end":57,"text":"CONST PDZRM : PD : ZR : PD ZR : !"},"type_definitions":[{"line_start":88,"line_end":88,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"PDZRM","type_code":"%","type_codes":["%"],"n_sublattices":3,"site_ratios":[1,1,1],"constituents":[["PD"],["ZR"],["PD","ZR"]],"major_constituents":[[],[],[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":5,"by_kind":{"G":2,"L":3},"L_by_order":{"0":1,"1":1,"2":1},"interaction_orders":[0,1,2],"endmember_G":2},"provenance":{"path":"databases/sgte-binary/PdZr-03Du.tdb","sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/PdZr-03Du.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/PdZr-03Du.tdb"}},"tdb_comment_structure":["Prototype MoSi2, both Pd2Zr and PdZr2"]}],"stoichiometry":null,"stability":[{"tdb":"PdZr-03Du.tdb","tdb_sha256":"3c13287a6b36d5e10bc05adf5bba4fab24819fd025a128abb54468750262045d","diagram":"phase-diagrams/sgte/PdZr-03Du.json","status":"ok","x_element":"ZR","calc_T_range_K":[300,4000],"stable":true,"T_min_K":300.0,"T_max_K":1883.16,"x_min":0.33334,"x_max":0.66667,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":false,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.3139/146.030864","citation":"Z. Du, Z. Metallkd., 94, 864-70(2003).","roles":["assessment that models this phase"],"labels":["PDZRM"],"values":0,"tdb_files":["PdZr-03Du.tdb"]}],"total_papers":1}],"structure_types":{"st:a1-cu-cf4":{"id":"st:a1-cu-cf4","prototype":"Cu","prototype_spellings":[],"strukturbericht":"A1","pearson":"cF4","space_group":{"number":225,"symbol":"Fm-3m"},"stoichiometry":null,"sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":4},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":1177},"st:a2-w-ci2":{"id":"st:a2-w-ci2","prototype":"W","prototype_spellings":[],"strukturbericht":"A2","pearson":"cI2","space_group":{"number":229,"symbol":"Im-3m"},"stoichiometry":null,"sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":7},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":1216},"st:a3-mg-hp2":{"id":"st:a3-mg-hp2","prototype":"Mg","prototype_spellings":[],"strukturbericht":"A3","pearson":"hP2","space_group":{"number":194,"symbol":"P6_3/mmc"},"stoichiometry":null,"sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":15},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":1210},"st:b2-cscl-cp2":{"id":"st:b2-cscl-cp2","prototype":"CsCl","prototype_spellings":[],"strukturbericht":"B2","pearson":"cP2","space_group":{"number":221,"symbol":"Pm-3m"},"stoichiometry":"Cl1Cs1","sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":132},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":169},"st:b33-crb-oc8":{"id":"st:b33-crb-oc8","prototype":"CrB","prototype_spellings":[],"strukturbericht":"B33","pearson":"oC8","space_group":{"number":63,"symbol":"Cmcm"},"stoichiometry":"B1Cr1","sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":82},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":78},"st:d0-24-ni3ti-hp16":{"id":"st:d0-24-ni3ti-hp16","prototype":"Ni3Ti","prototype_spellings":[],"strukturbericht":"D0_24","pearson":"hP16","space_group":{"number":194,"symbol":"P6_3/mmc"},"stoichiometry":"Ni3Ti1","sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":12},{"citation":"P. Villars, L. D. Calvert, Pearson's Handbook of Crystallographic Data for Intermetallic Phases, 2nd ed., ASM International (1991)","doi":null},{"citation":"M. J. Mehl et al., The AFLOW Library of Crystallographic Prototypes: Part 1, Comput. Mater. Sci. 136 (2017) S1-S828","doi":"10.1016/j.commatsci.2017.01.017"}],"verification":"built-in row confirmed by Hallstedt 2025 mmc2 (Strukturbericht, Pearson, space group)","registry_phases":5},"st:liquid":{"id":"st:liquid","prototype":null,"prototype_spellings":[],"strukturbericht":null,"pearson":null,"space_group":null,"stoichiometry":null,"sources":[],"verification":"definition (non-crystalline)","registry_phases":1304},"st:ni11zr9-tp44":{"id":"st:ni11zr9-tp44","prototype":"Ni11Zr9","prototype_spellings":[],"strukturbericht":null,"pearson":"tP44","space_group":{"number":83,"symbol":"P4/m"},"stoichiometry":"Ni11Zr9","sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":1}],"verification":"in Hallstedt 2025 mmc2","registry_phases":1},"st:pd4pu3-hr14":{"id":"st:pd4pu3-hr14","prototype":"Pd4Pu3","prototype_spellings":[],"strukturbericht":null,"pearson":"hR14","space_group":{"number":148,"symbol":"R-3"},"stoichiometry":"Pd4Pu3","sources":[{"citation":"B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, supplementary crystallographic table (mmc2)","doi":"10.1016/j.calphad.2025.102833","license":"CC BY 4.0","rows":22}],"verification":"in Hallstedt 2025 mmc2","registry_phases":22}},"cite_as":{"dataset":"phase-registry","version":"2026.10","release_tag":"v2026.10","license":"CC-BY-4.0","status":"Version 1, machine-extracted: values were read by language-model readers constrained to quote their source and checked automatically, and the release was then audited on the printed pages by adversarial audits, an independent second review of fit-facing records and a preliminary human review of a frozen sample. Flags such as accepted and ESPEI-ready record screening results, not certification; known issues are listed in the release notes.","title":"ORCHID-Registry: phase registry of binary systems","doi":"10.5281/zenodo.23735970","url":"https://doi.org/10.5281/zenodo.23735970","text":"R. Arróyave, J. Saal, D. Shin, ORCHID-Registry: phase registry of binary systems (version 2026.10; Version 1, machine-extracted), Zenodo (2026). https://doi.org/10.5281/zenodo.23735970","bibtex":"@misc{orchid_phase_registry_2026,\n  author    = {Arr{\\'o}yave, Raymundo and Saal, James and Shin, Dongwon},\n  title     = {{ORCHID-Registry: phase registry of binary systems}},\n  version   = {2026.10},\n  publisher = {Zenodo},\n  year      = {2026},\n  doi       = {10.5281/zenodo.23735970},\n  url       = {https://doi.org/10.5281/zenodo.23735970},\n  note      = {Version 1, machine-extracted}\n}","also_cite":["B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, https://doi.org/10.1016/j.calphad.2025.102833 (CC BY 4.0), and the original assessment named in each file","A. Jain et al., The Materials Project: A materials genome approach to accelerating materials innovation, APL Materials 1 (2013) 011002, https://doi.org/10.1063/1.4812323 (CC BY 4.0)","J. E. Saal et al., JOM 65 (2013) 1501, https://doi.org/10.1007/s11837-013-0755-4 and S. Kirklin et al., npj Comput. Mater. 1 (2015) 15010, https://doi.org/10.1038/npjcompumats.2015.10 (CC BY 4.0)","the original source of every value you use (paper_citation / paper_doi, and cited_dois for values the paper cites from earlier work)"],"part_of":{"title":"ORCHID data: umbrella record of the ORCHID datasets","doi":"10.5281/zenodo.23736065","url":"https://doi.org/10.5281/zenodo.23736065","text":"R. Arróyave, J. Saal, D. Shin, ORCHID data: umbrella record of the ORCHID datasets (version 2026.10; Version 1, machine-extracted), Zenodo (2026). https://doi.org/10.5281/zenodo.23736065","bibtex":"@misc{orchid_data_2026,\n  author    = {Arr{\\'o}yave, Raymundo and Saal, James and Shin, Dongwon},\n  title     = {{ORCHID data: umbrella record of the ORCHID datasets}},\n  version   = {2026.10},\n  publisher = {Zenodo},\n  year      = {2026},\n  doi       = {10.5281/zenodo.23736065},\n  url       = {https://doi.org/10.5281/zenodo.23736065},\n  note      = {Version 1, machine-extracted}\n}"}}}
