{"id":"W2921627266","doi":"10.1021/acscatal.8b04929","title":"Operando XAFS Studies on Rh(CAAC)-Catalyzed Arene Hydrogenation","year":2019,"lang":"en","type":"article","venue":"ACS Catalysis","topic":"Asymmetric Hydrogenation and Catalysis","field":"Chemistry","cited_by":47,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Pacific Northwest National Laboratory; Argonne National Laboratory; Basic Energy Sciences; Office of Science; Canadian Light Source; Battelle; U.S. Department of Energy","keywords":"Chemistry; Benzothiophene; X-ray absorption fine structure; Catalysis; Rhodium; Nanoparticle; Photochemistry; Alkyl; Reactivity (psychology); Ether; Medicinal chemistry; Organic chemistry; Thiophene; Materials science; Spectroscopy; Nanotechnology","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002226145,0.0003753652,0.0003401765,0.000203551,0.0001941276,0.0002540377,0.0002957924,0.0004380775,0.001899679],"category_scores_gemma":[0.0002162086,0.0001848507,0.0002902912,0.0001905639,0.0002779721,0.0002769399,0.0001884498,0.0005640572,0.0003018317],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002869421,"about_ca_system_score_gemma":0.0001113479,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001134868,"about_ca_topic_score_gemma":0.001390469,"domain_scores_codex":[0.9998265,0.00001552406,0.000010804,0.00003912629,0.00006642113,0.00004166628],"domain_scores_gemma":[0.9997961,0.00007529702,0.00004408688,0.00002149178,0.00004858056,0.00001437987],"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":[0.00008004228,0.00001625819,0.0001275283,0.00002559345,0.000004031607,0.00003663202,0.00002717498,0.00007838327,0.9989527,0.00004272212,0.00002587119,0.000583043],"study_design_scores_gemma":[0.000004808696,0.00005809909,0.001549933,0.000001458905,0.000002972366,0.00003109084,0.00001768072,0.0005499027,0.9974914,0.00001188451,0.0002770077,0.000003806735],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9978306,0.0001758084,0.0007822965,0.00003695731,0.000009340556,0.00001520946,0.0001615835,0.0000530239,0.0009351574],"genre_scores_gemma":[0.9974144,0.0002019395,0.001072816,0.00001830683,0.000005736039,0.00001524711,0.0001308396,0.00002074972,0.001120024],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001899679,"threshold_uncertainty_score":0.006355107,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01781147984248906,"score_gpt":0.2689672571784048,"score_spread":0.2511557773359158,"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."}}