{"id":"W2024236757","doi":"10.1021/jp0506944","title":"Cluster Size Selectivity in the Product Distribution of Ethene Dehydrogenation on Niobium Clusters","year":2005,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry A","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":15,"is_retracted":false,"has_abstract":true,"ca_institutions":"Trent University; Steacie Institute for Molecular Sciences; Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada; Consejo Nacional de Ciencia y Tecnología; Dirección General de Asuntos del Personal Académico, Universidad Nacional Autónoma de México; National Science Foundation","keywords":"Dehydrogenation; Cluster (spacecraft); Chemistry; Selectivity; Steric effects; Thermochemistry; Product distribution; Molecule; Kinetic energy; Photochemistry; Physical chemistry; Catalysis; Stereochemistry; Organic chemistry","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001618554,0.0002374953,0.0002572499,0.0002179611,0.0002961635,0.0002882171,0.0003950566,0.0002029247,0.001388976],"category_scores_gemma":[0.0003443034,0.0001942085,0.0001973229,0.0001483003,0.0002381704,0.0002899833,0.0002067842,0.0002159611,0.000201485],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005710206,"about_ca_system_score_gemma":0.0001983948,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004063975,"about_ca_topic_score_gemma":0.005306239,"domain_scores_codex":[0.9998759,0.00001223826,0.000005395259,0.00003383041,0.00004361324,0.00002899499],"domain_scores_gemma":[0.9998889,0.00004717535,0.00001584614,0.00001137172,0.00002813937,0.000008576632],"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":[0.000630142,0.00002478754,0.002794645,0.0001479288,0.0000239228,0.00008994895,0.0001756281,0.006485627,0.9857232,0.000854403,0.0001197875,0.002929794],"study_design_scores_gemma":[0.00002467267,0.0001859347,0.009024529,0.000006305254,0.00002068411,0.0000557073,0.0000811518,0.01592988,0.9736018,0.0001160775,0.0009344423,0.00001889662],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9981182,0.0001602781,0.0004475747,0.00001699507,0.000002168443,0.000005957531,0.00008068327,0.00002231209,0.001145997],"genre_scores_gemma":[0.9990804,0.0001158441,0.000298687,0.000002132107,7.947962e-7,0.000006557663,0.0001352573,0.000008201058,0.000352064],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004063975,"threshold_uncertainty_score":0.008080602,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006558341295252994,"score_gpt":0.2521567747110581,"score_spread":0.2455984334158051,"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."}}