{"id":"W1979682331","doi":"10.1088/0953-8984/20/6/064241","title":"A systematic computational study of electronic effects on hydrogen sensitivity of olefin polymerization catalysts (abstract only)","year":2008,"lang":"en","type":"article","venue":"Journal of Physics Condensed Matter","topic":"Polymer crystallization and properties","field":"Materials Science","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Manitoba","funders":"","keywords":"Electrophile; Catalysis; Hydrogen; Polymerization; Chemistry; Reaction rate constant; Olefin polymerization; Olefin fiber; Computational chemistry; Chemical physics; Organic chemistry; Kinetics; Physics; Polymer","routes":{"ca_aff":true,"ca_fund":false,"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":[0.0008358076,0.0006647694,0.001189253,0.0006208326,0.0006522667,0.0007352308,0.0008239336,0.0009937836,0.002553816],"category_scores_gemma":[0.002573702,0.0004115145,0.0007105732,0.0009357611,0.0006104073,0.000491356,0.0005705209,0.0009186863,0.0001560207],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00076221,"about_ca_system_score_gemma":0.000953662,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.007277762,"about_ca_topic_score_gemma":0.008459354,"domain_scores_codex":[0.9998534,0.00006374119,0.000007792654,0.00001802873,0.00002653886,0.00003052601],"domain_scores_gemma":[0.9976545,0.001975752,0.0000681904,0.0001074125,0.0001437242,0.00005061081],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.000370713,0.0002485856,0.006788048,0.0007232352,0.0001868312,0.0002567325,0.00008849029,0.971409,0.001751194,0.00595888,0.003292599,0.008925704],"study_design_scores_gemma":[0.0001355652,0.0001546313,0.001949654,0.00005073413,0.00005463099,0.00002469134,0.0000722348,0.9942551,0.001051028,0.001480317,0.0007578876,0.0000134861],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9827879,0.0009630425,0.004116152,0.0005510419,0.00005486892,0.00009029531,0.001985998,0.0002398096,0.009210926],"genre_scores_gemma":[0.9903432,0.0003820333,0.006548665,0.0002064702,0.00002468937,0.0002574208,0.001352177,0.00008624129,0.0007990981],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007277762,"threshold_uncertainty_score":0.01447082,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01170310523324537,"score_gpt":0.2274923758606808,"score_spread":0.2157892706274354,"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."}}