{"id":"W2542439507","doi":"10.1021/acs.inorgchem.6b01949","title":"Structure and Electronic Properties of Fe<sub>2</sub>SH<sub>3</sub> Compound under High Pressure","year":2016,"lang":"en","type":"article","venue":"Inorganic Chemistry","topic":"Nuclear Materials and Properties","field":"Materials Science","cited_by":53,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Saskatchewan","funders":"China Postdoctoral Science Foundation; Ministry of Science and Technology of the People's Republic of China; Ministry of Education of the People's Republic of China; National Natural Science Foundation of China; Natural Science Foundation of Jilin Province","keywords":"Chemistry; Electronic structure; High pressure; Crystallography; Crystal structure; Stereochemistry; Computational chemistry; Thermodynamics","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00006964234,0.0001677085,0.0001770555,0.0002156104,0.0004236137,0.0002407521,0.0002530089,0.0003927774,0.002251815],"category_scores_gemma":[0.0001696455,0.0001314932,0.0001155454,0.0002135558,0.0003731546,0.0001962174,0.0001325899,0.0002257616,0.0001696712],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003175124,"about_ca_system_score_gemma":0.0002037885,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001806281,"about_ca_topic_score_gemma":0.002083491,"domain_scores_codex":[0.9999604,0.000004854151,0.000001460635,0.000006204747,0.00001632658,0.00001071639],"domain_scores_gemma":[0.9999354,0.00001916632,0.00001431096,0.000005584748,0.00001719446,0.000008445088],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001143781,0.0001072535,0.009514613,0.0006484158,0.00007415088,0.001346898,0.0003860873,0.01474289,0.9495338,0.01025119,0.003464221,0.008786668],"study_design_scores_gemma":[0.0003124266,0.001816835,0.07018111,0.00006619248,0.0001009007,0.001220081,0.000750323,0.2413193,0.6738341,0.004660971,0.005661945,0.00007586674],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9979678,0.00008929078,0.0001825213,0.00006450507,0.000005874415,0.000003720151,0.0001097118,0.00002358376,0.00155315],"genre_scores_gemma":[0.9989231,0.00005156821,0.0003732323,0.00001716587,0.000004835811,0.00000684819,0.0001823096,0.000008502017,0.0004324181],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002251815,"threshold_uncertainty_score":0.007533014,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006671223232696209,"score_gpt":0.1730790076541417,"score_spread":0.1664077844214455,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}