{"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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":["insufficient_payload"],"category_scores_codex":[0.0003944294,0.000376459,0.0006537291,0.0004827222,0.0001929115,0.00005421245,0.0005172468,0.0001857766,0.001285338],"category_scores_gemma":[0.0004236728,0.0003337501,0.0003791551,0.001435139,0.00007165186,0.0002773843,0.0001647189,0.000227136,0.003508675],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002771873,"about_ca_system_score_gemma":0.00005593127,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005512576,"about_ca_topic_score_gemma":0.00002797688,"domain_scores_codex":[0.9974027,0.0000356379,0.0006249375,0.0007549973,0.0007946437,0.0003870947],"domain_scores_gemma":[0.9978967,0.0002585179,0.0003075655,0.00112604,0.0002567487,0.0001543796],"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":[0.0007046204,0.001757949,0.0174687,0.0006822748,0.01302775,0.0000828069,0.008350377,0.006457907,0.8787212,0.003587706,0.004972707,0.06418599],"study_design_scores_gemma":[0.00198363,0.00002675955,0.0001296709,0.00004595609,0.0005539969,0.00001013912,0.002048583,0.0009900338,0.9872941,0.0001621298,0.006162327,0.0005926251],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9769651,0.0009871548,0.00002746971,0.0003546507,0.0001769612,0.0001406506,0.00004321385,0.0002036742,0.0211011],"genre_scores_gemma":[0.9872926,0.0002470096,0.00004656367,0.0002935355,0.0001417632,0.00008642433,0.001501967,0.00005324927,0.01033685],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1085729,"threshold_uncertainty_score":0.9999114,"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."}}