{"id":"W4401353114","doi":"10.1021/acs.langmuir.4c01446","title":"Energetics and Redox Kinetics of Pure Ferrocene-Terminated <i>N</i>-Heterocyclic Carbene Self-Assembled Monolayers on Gold","year":2024,"lang":"en","type":"article","venue":"Langmuir","topic":"Molecular Junctions and Nanostructures","field":"Engineering","cited_by":7,"is_retracted":false,"has_abstract":true,"ca_institutions":"Queen's University; University of Calgary","funders":"Social Sciences and Humanities Research Council of Canada; Canadian Institutes of Health Research; Canada Foundation for Innovation; Alberta Innovates; University of Calgary; Natural Sciences and Engineering Research Council of Canada; Queen's University; Canada First Research Excellence Fund; Canada Research Chairs; Innovation for Defence Excellence and Security","keywords":"Monolayer; Ferrocene; Chemistry; Carbene; Oxidizing agent; Redox; Self-assembled monolayer; Kinetics; Homogeneous; Crystallography; Molecule; Energetics; Stereochemistry; Photochemistry; Polymer chemistry; Electrochemistry; Inorganic chemistry; Organic chemistry; Physical chemistry; Catalysis; Electrode","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00001831958,0.0001506329,0.0001543933,0.0001239056,0.0000156104,0.00003153255,0.00007336435,0.0001166573,0.000008415902],"category_scores_gemma":[0.00000362848,0.0001338806,0.00004886559,0.0001866531,0.000007284159,0.00002888546,0.00002157346,0.0001248941,0.000004075212],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002554373,"about_ca_system_score_gemma":0.000003107122,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000008122807,"about_ca_topic_score_gemma":0.000009001425,"domain_scores_codex":[0.999418,0.00001140034,0.0001518405,0.000156719,0.0001053095,0.0001567408],"domain_scores_gemma":[0.9997415,0.00001839821,0.00001450885,0.0001606382,0.00001726348,0.00004769201],"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":[0.000008221245,0.00001899424,0.00007980834,0.0003464501,0.0001080542,0.00005151065,0.0004097288,0.002344278,0.9900287,0.0004841769,0.002699054,0.003420992],"study_design_scores_gemma":[0.0003025533,0.0001352337,0.003448872,0.0001083237,0.0001054601,0.00003934663,0.0000385094,0.02210018,0.9455596,0.0001386222,0.02773428,0.0002890414],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.994817,0.002240702,0.0001694906,0.00005195203,0.0003755087,0.00007669631,0.00001411315,0.00032762,0.001926885],"genre_scores_gemma":[0.9991341,0.0002755698,0.0003536408,0.00003503312,0.00006346676,0.000006978962,0.00001152846,0.00004329163,0.00007644424],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.04446916,"threshold_uncertainty_score":0.5459495,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004207583138186212,"score_gpt":0.1999753272019245,"score_spread":0.1957677440637383,"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."}}