{"id":"W2990280890","doi":"10.1021/acs.langmuir.9b02401","title":"Strong Metal–Adsorbate Interactions Increase the Reactivity and Decrease the Orientational Order of OH-Functionalized N-Heterocyclic Carbene Monolayers","year":2019,"lang":"en","type":"article","venue":"Langmuir","topic":"N-Heterocyclic Carbenes in Organic and Inorganic Chemistry","field":"Chemistry","cited_by":39,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"H2020 European Research Council; Ministry of Energy, Israel; Basic Energy Sciences; Ministry of Science and Technology, Israel; Azrieli Foundation","keywords":"Reactivity (psychology); Dehydrogenation; Chemistry; Monolayer; Molecule; X-ray photoelectron spectroscopy; Aromatization; Carbene; Photochemistry; Crystallography; Catalysis; Organic chemistry; Chemical engineering","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":[0.00006621416,0.0002244127,0.0001354212,0.000123214,0.0001135242,0.000209483,0.0001923729,0.0002225135,0.001075633],"category_scores_gemma":[0.000162425,0.0001475476,0.0001246333,0.00008113683,0.0001536739,0.0002113464,0.0001442683,0.0002909809,0.0001584285],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001552979,"about_ca_system_score_gemma":0.00009223774,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005144726,"about_ca_topic_score_gemma":0.001571122,"domain_scores_codex":[0.9998902,0.000009162114,0.000005875026,0.00002373778,0.00003950094,0.00003153037],"domain_scores_gemma":[0.9999154,0.00002405382,0.00002241982,0.000008226642,0.00001475567,0.00001511285],"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":[0.00001845465,0.000008068902,0.0001330911,0.00001482264,0.00000272134,0.00001155502,0.000006586161,0.00003240462,0.999289,0.00004240401,0.00001409685,0.0004267198],"study_design_scores_gemma":[0.00000311624,0.000060229,0.002665491,0.000001665025,0.000005835465,0.0000224895,0.00001324429,0.0004243228,0.9964217,0.0000119228,0.000367941,0.000002116208],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9977767,0.0003560282,0.0006019368,0.00002900075,0.00000975758,0.00000685337,0.00003051827,0.00001857619,0.001170695],"genre_scores_gemma":[0.9984125,0.0001805519,0.0006144362,0.00002516116,0.000003292972,0.000005986379,0.00004028856,0.000005179549,0.0007125314],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001075633,"threshold_uncertainty_score":0.003598332,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009213578661224641,"score_gpt":0.2399049882885187,"score_spread":0.2306914096272941,"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."}}