{"system":"CA-H","release":"v2026.10","phases":[{"id":"phase:ca-h:bcc-a2","system":"CA-H","elements":["CA","H"],"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:CaH-11Wan.tdb:BCC_A2","namespace":"tdb","label":"BCC_A2","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:BCC_A2","namespace":"tdb","label":"BCC_A2","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:bcc-a2","namespace":"corpus","label":"phase:ca-h:bcc-a2","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"BCC_A2","type_code":"%B","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":1.5,"constituents":["H","VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":40,"line_end":40,"text":"PHASE BCC_A2 %B 2 1 1.5 !"},"constituent":{"line_start":41,"line_end":41,"text":"CONST BCC_A2 : CA : H VA% : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":67,"line_end":67,"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":[1,1.5],"constituents":[["CA"],["H","VA%"]],"major_constituents":[[],["VA"]],"magnetic":{"type_code":"B","afm_factor":-1,"structure_fraction":0.4,"line":67},"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/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"BCC_A2","type_code":"%B","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":3.0,"constituents":["H","VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":37,"line_end":37,"text":"PHASE BCC_A2 %B 2 1 3 !"},"constituent":{"line_start":38,"line_end":38,"text":"CONST BCC_A2 : CA : H VA% : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":64,"line_end":64,"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":[["CA"],["H","VA%"]],"major_constituents":[[],["VA"]],"magnetic":{"type_code":"B","afm_factor":-1,"structure_fraction":0.4,"line":64},"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":688.01,"T_max_K":1306.02,"x_min":0.0,"x_max":0.32471,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":716.03,"T_max_K":1163.62,"x_min":0.0,"x_max":0.3427,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["BCC_A2"],"values":0,"tdb_files":["CaH-12Wan.tdb"]},{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase"],"labels":["BCC_A2"],"values":0,"tdb_files":["CaH-11Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:cah2-beta","system":"CA-H","elements":["CA","H"],"preferred_name":"CAH2_BETA","status":"needs_review","structure":null,"candidates":[{"source":"dft_mp","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":62,"symbol":"Pnma"},"detail":"on-hull MP CaH2 at x(H)=0.6667","material_id":"mp-aaaabjcb"},{"source":"dft_oqmd","structure_type":null,"prototype":null,"strukturbericht":null,"pearson":null,"space_group":{"number":62,"symbol":"Pnma"},"detail":"on-hull OQMD Ca1 H2 at x(H)=0.6667","material_id":"oqmd-642891"},{"source":"sgte_mmc2","structure_type":"st:cah2-beta","prototype":"(CaH2-beta)","strukturbericht":null,"pearson":null,"space_group":{"number":225,"symbol":"Fm-3m"},"detail":"Hallstedt 2025 mmc2 row for CAH2_BETA: CaH2-beta (possibly CaF2 structure)"}],"review_reasons":["no_structure_token","polymorph_family:other phases of this system have the same composition"],"names":[{"name":"paper:10.1016/j.ijhydene.2011.08.018:βCaH2","namespace":"paper","label":"βCaH2","basis":"corpus_mapping:unstated"},{"name":"tdb:CaH-11Wan.tdb:CAH2_BETA","namespace":"tdb","label":"CAH2_BETA","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:CAH2_BETA","namespace":"tdb","label":"CAH2_BETA","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:cah2-beta","namespace":"corpus","label":"phase:ca-h:cah2-beta","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"CAH2_BETA","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":2.0,"constituents":["H"]}],"stoichiometric":true,"composition":{"CA":0.3333333333333333,"H":0.6666666666666666},"tdb_definition":{"verbatim":{"phase":{"line_start":55,"line_end":55,"text":"PHASE CAH2_BETA % 2 1 2 !"},"constituent":{"line_start":56,"line_end":56,"text":"CONST CAH2_BETA : CA : H : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"CAH2_BETA","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,2],"constituents":[["CA"],["H"]],"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/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"CAH2_BETA","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":2.0,"constituents":["H"]}],"stoichiometric":true,"composition":{"CA":0.3333333333333333,"H":0.6666666666666666},"tdb_definition":{"verbatim":{"phase":{"line_start":52,"line_end":52,"text":"PHASE CAH2_BETA % 2 1 2 !"},"constituent":{"line_start":53,"line_end":53,"text":"CONST CAH2_BETA : CA : H : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"CAH2_BETA","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,2],"constituents":[["CA"],["H"]],"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":{"CA":0.3333333333333333,"H":0.6666666666666666},"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":1053.15,"T_max_K":1257.01,"x_min":0.66667,"x_max":0.66667,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":1053.28,"T_max_K":1255.76,"x_min":0.66667,"x_max":0.66667,"stable_at_top_of_range":false}],"literature":{"values":2,"accepted_values":2,"papers":1},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase","reports values for this phase"],"labels":["CAH2_BETA","βCaH2"],"values":2,"tdb_files":["CaH-11Wan.tdb"]},{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["CAH2_BETA"],"values":0,"tdb_files":["CaH-12Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:cah2-c37","system":"CA-H","elements":["CA","H"],"preferred_name":"CAH2_C37","status":"assigned","structure":{"structure_type":"st:c37-co2si-op12","basis":"standard_name","tier":"A","confidence":"high","label":"from the standard phase name","prototype":"Co2Si","strukturbericht":"C37","pearson":"oP12","space_group":{"number":62,"symbol":"Pnma"}},"candidates":[],"review_reasons":[],"names":[{"name":"paper:10.1016/j.ijhydene.2011.08.018:αCaH2","namespace":"paper","label":"αCaH2","basis":"corpus_mapping:unstated"},{"name":"tdb:CaH-11Wan.tdb:CAH2_C37","namespace":"tdb","label":"CAH2_C37","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:CAH2_C37","namespace":"tdb","label":"CAH2_C37","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:cah2-c37","namespace":"corpus","label":"phase:ca-h:cah2-c37","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"CAH2_C37","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":2.0,"constituents":["H"]}],"stoichiometric":true,"composition":{"CA":0.3333333333333333,"H":0.6666666666666666},"tdb_definition":{"verbatim":{"phase":{"line_start":50,"line_end":50,"text":"PHASE CAH2_C37 % 2 1 2 !"},"constituent":{"line_start":51,"line_end":51,"text":"CONST CAH2_C37 : CA : H : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"CAH2_C37","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,2],"constituents":[["CA"],["H"]],"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/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"CAH2_C37","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":2.0,"constituents":["H"]}],"stoichiometric":true,"composition":{"CA":0.3333333333333333,"H":0.6666666666666666},"tdb_definition":{"verbatim":{"phase":{"line_start":47,"line_end":47,"text":"PHASE CAH2_C37 % 2 1 2 !"},"constituent":{"line_start":48,"line_end":48,"text":"CONST CAH2_C37 : CA : H : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"CAH2_C37","type_code":"%","type_codes":["%"],"n_sublattices":2,"site_ratios":[1,2],"constituents":[["CA"],["H"]],"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":{"CA":0.3333333333333333,"H":0.6666666666666666},"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":1053.15,"x_min":0.66667,"x_max":0.66667,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":1053.28,"x_min":0.66667,"x_max":0.66667,"stable_at_top_of_range":false}],"literature":{"values":9,"accepted_values":9,"papers":1},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase","reports values for this phase"],"labels":["CAH2_C37","αCaH2"],"values":9,"tdb_files":["CaH-11Wan.tdb"]},{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["CAH2_C37"],"values":0,"tdb_files":["CaH-12Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:fcc-a1","system":"CA-H","elements":["CA","H"],"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:CaH-11Wan.tdb:FCC_A1","namespace":"tdb","label":"FCC_A1","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:FCC_A1","namespace":"tdb","label":"FCC_A1","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:fcc-a1","namespace":"corpus","label":"phase:ca-h:fcc-a1","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"FCC_A1","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":1.0,"constituents":["H","VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":35,"line_end":35,"text":"PHASE FCC_A1 %A 2 1 1 !"},"constituent":{"line_start":36,"line_end":36,"text":"CONST FCC_A1 : CA% : H VA% : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":66,"line_end":66,"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":[["CA%"],["H","VA%"]],"major_constituents":[["CA"],["VA"]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":66},"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/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"FCC_A1","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":1.0,"constituents":["H","VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":32,"line_end":32,"text":"PHASE FCC_A1 %A 2 1 1 !"},"constituent":{"line_start":33,"line_end":33,"text":"CONST FCC_A1 : CA% : H VA% : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":63,"line_end":63,"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":[["CA%"],["H","VA%"]],"major_constituents":[["CA"],["VA"]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":63},"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":1306.02,"x_min":0.0,"x_max":0.0061,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":720.47,"x_min":0.0,"x_max":0.01797,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["FCC_A1"],"values":0,"tdb_files":["CaH-12Wan.tdb"]},{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase"],"labels":["FCC_A1"],"values":0,"tdb_files":["CaH-11Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:gas","system":"CA-H","elements":["CA","H"],"preferred_name":"GAS","status":"assigned","structure":{"structure_type":"st:gas","basis":"gas","confidence":"high","label":"gas","prototype":null,"strukturbericht":null,"pearson":null,"space_group":null},"candidates":[],"review_reasons":[],"names":[{"name":"tdb:CaH-11Wan.tdb:GAS","namespace":"tdb","label":"GAS","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:GAS","namespace":"tdb","label":"GAS","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:gas","namespace":"corpus","label":"phase:ca-h:gas","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"GAS","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA","CA2","CAH","H","H2"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":58,"line_end":58,"text":"PHASE GAS:G % 1 1 !"},"constituent":{"line_start":59,"line_end":59,"text":"CONST GAS:G : CA CA2 CAH H H2 : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"GAS","type_code":"%","type_codes":["%"],"n_sublattices":1,"site_ratios":[1],"constituents":[["CA","CA2","CAH","H","H2"]],"major_constituents":[[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":5,"by_kind":{"G":5},"L_by_order":{},"interaction_orders":[],"endmember_G":5},"provenance":{"path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"GAS","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA","CA2","CAH","H","H2"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":55,"line_end":55,"text":"PHASE GAS:G % 1 1 !"},"constituent":{"line_start":56,"line_end":56,"text":"CONST GAS:G : CA CA2 CAH H H2 : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"GAS","type_code":"%","type_codes":["%"],"n_sublattices":1,"site_ratios":[1],"constituents":[["CA","CA2","CAH","H","H2"]],"major_constituents":[[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":5,"by_kind":{"G":5},"L_by_order":{},"interaction_orders":[],"endmember_G":5},"provenance":{"path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":2500.0,"x_min":0.0,"x_max":1.0,"stable_at_top_of_range":true},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":300.0,"T_max_K":2500.0,"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":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["GAS"],"values":0,"tdb_files":["CaH-12Wan.tdb"]},{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase"],"labels":["GAS"],"values":0,"tdb_files":["CaH-11Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:hcp-a3","system":"CA-H","elements":["CA","H"],"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":"paper:10.1016/j.ijhydene.2011.08.018:CaH","namespace":"paper","label":"CaH","basis":"corpus_mapping:unstated"},{"name":"tdb:CaH-11Wan.tdb:HCP_A3","namespace":"tdb","label":"HCP_A3","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:HCP_A3","namespace":"tdb","label":"HCP_A3","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:hcp-a3","namespace":"corpus","label":"phase:ca-h:hcp-a3","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"HCP_A3","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["CA","CAH2"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":45,"line_end":45,"text":"PHASE HCP_A3 %A 1 1 !"},"constituent":{"line_start":46,"line_end":46,"text":"CONST HCP_A3 : CA CAH2 : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":66,"line_end":66,"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":1,"site_ratios":[1],"constituents":[["CA","CAH2"]],"major_constituents":[[]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":66},"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/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"HCP_A3","type_code":"%A","sublattices":[{"site_ratio":1.0,"constituents":["CA"]},{"site_ratio":0.5,"constituents":["H","VA"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":42,"line_end":42,"text":"PHASE HCP_A3 %A 2 1 0.5 !"},"constituent":{"line_start":43,"line_end":43,"text":"CONST HCP_A3 : CA : H VA% : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null},{"line_start":63,"line_end":63,"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":[["CA"],["H","VA%"]],"major_constituents":[[],["VA"]],"magnetic":{"type_code":"A","afm_factor":-3,"structure_fraction":0.28,"line":63},"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":624.48,"T_max_K":878.76,"x_min":0.01954,"x_max":0.16929,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":630.31,"T_max_K":872.02,"x_min":0.01318,"x_max":0.14594,"stable_at_top_of_range":false}],"literature":{"values":1,"accepted_values":1,"papers":1},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase","reports values for this phase"],"labels":["CaH","HCP_A3"],"values":1,"tdb_files":["CaH-11Wan.tdb"]},{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["HCP_A3"],"values":0,"tdb_files":["CaH-12Wan.tdb"]}],"total_papers":2},{"id":"phase:ca-h:liquid","system":"CA-H","elements":["CA","H"],"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:CaH-11Wan.tdb:LIQUID","namespace":"tdb","label":"LIQUID","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816"},{"name":"tdb:CaH-12Wan.tdb:LIQUID","namespace":"tdb","label":"LIQUID","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60"},{"name":"corpus:phase:ca-h:liquid","namespace":"corpus","label":"phase:ca-h:liquid","in_sgte_corpus":true}],"models":[{"tdb":"CaH-11Wan.tdb","path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","phase_name":"LIQUID","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA","CAH2","H"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":30,"line_end":30,"text":"PHASE LIQUID:L % 1 1 !"},"constituent":{"line_start":31,"line_end":31,"text":"CONST LIQUID:L : CA CAH2 H : !"},"type_definitions":[{"line_start":65,"line_end":65,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"LIQUID","type_code":"%","type_codes":["%"],"n_sublattices":1,"site_ratios":[1],"constituents":[["CA","CAH2","H"]],"major_constituents":[[]],"magnetic":null,"disordered_part":null,"ordered_partner":null},"parameters":{"total":6,"by_kind":{"G":3,"L":3},"L_by_order":{"0":2,"1":1},"interaction_orders":[0,1],"endmember_G":3},"provenance":{"path":"databases/sgte-binary/CaH-11Wan.tdb","sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-11Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-11Wan.tdb"}}},{"tdb":"CaH-12Wan.tdb","path":"databases/sgte-binary/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","phase_name":"LIQUID","type_code":"%","sublattices":[{"site_ratio":1.0,"constituents":["CA","H"]}],"stoichiometric":false,"composition":null,"tdb_definition":{"verbatim":{"phase":{"line_start":27,"line_end":27,"text":"PHASE LIQUID:L % 1 1 !"},"constituent":{"line_start":28,"line_end":28,"text":"CONST LIQUID:L : CA H : !"},"type_definitions":[{"line_start":62,"line_end":62,"text":"TYPE-DEF % SEQ * !","type_code":"%","amends":null}]},"parsed":{"phase_name":"LIQUID","type_code":"%","type_codes":["%"],"n_sublattices":1,"site_ratios":[1],"constituents":[["CA","H"]],"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/CaH-12Wan.tdb","sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","decoded_as":"utf-8","website_url":"https://orchid-project.org/data/databases/sgte-binary/CaH-12Wan.tdb","github_url":"https://github.com/orchid-calphad/orchid-pipeline/blob/main/databases/sgte-binary/CaH-12Wan.tdb"}}}],"stoichiometry":null,"stability":[{"tdb":"CaH-11Wan.tdb","tdb_sha256":"10f2af8543f879eea519b3257ccb4ed867e5a1c0b5eb1e7f2644b333ddf32816","diagram":"phase-diagrams/sgte/CaH-11Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":1111.53,"T_max_K":2044.69,"x_min":0.0,"x_max":0.44007,"stable_at_top_of_range":false},{"tdb":"CaH-12Wan.tdb","tdb_sha256":"e8d5c286231e6b11e61859273f6b9ed396323a357b3c9b11e6104e8c44e9ad60","diagram":"phase-diagrams/sgte/CaH-12Wan.json","status":"ok","x_element":"H","stable":true,"T_min_K":1110.0,"T_max_K":2111.52,"x_min":0.0,"x_max":0.48736,"stable_at_top_of_range":false}],"literature":{"values":0,"accepted_values":0,"papers":0},"corpus":{"in_sgte_corpus":true,"phase_mappings":0,"mapping_basis":{},"printed_labels":[]},"references":[{"doi":"10.1007/s11669-012-9997-z","citation":"Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Lixian Sun et al., Thermodynamic Modeling of the Li-H and Ca-H Systems, J. Phase Equilib. Diffus. 33, 89-96 (2012).","roles":["assessment that models this phase"],"labels":["LIQUID"],"values":0,"tdb_files":["CaH-12Wan.tdb"]},{"doi":"10.1016/j.ijhydene.2011.08.018","citation":"Kun Wang, Junlin Du, Xiangcheng Kong, Xiaoqin Zeng, Jianxin Zou, Zhilin Li et al., Ab initio and thermodynamic investigation on the Ca–H system, International Journal of Hydrogen Energy 36, 13632-13639 (2011).","roles":["assessment that models this phase"],"labels":["LIQUID"],"values":0,"tdb_files":["CaH-11Wan.tdb"]}],"total_papers":2}],"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:c37-co2si-op12":{"id":"st:c37-co2si-op12","prototype":"Co2Si","prototype_spellings":[],"strukturbericht":"C37","pearson":"oP12","space_group":{"number":62,"symbol":"Pnma"},"stoichiometry":"Co2Si1","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":55}],"verification":"in Hallstedt 2025 mmc2","registry_phases":51},"st:gas":{"id":"st:gas","prototype":null,"prototype_spellings":[],"strukturbericht":null,"pearson":null,"space_group":null,"stoichiometry":null,"sources":[],"verification":"definition (non-crystalline)","registry_phases":231},"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}},"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}"}}}
