{"id":"W2051586337","doi":"10.1016/s0141-3910(02)00013-7","title":"Stabilization mechanism of antimony mercaptides in poly(vinyl chloride): ab initio theory studies","year":2002,"lang":"en","type":"article","venue":"Polymer Degradation and Stability","topic":"Polymer Science and PVC","field":"Materials Science","cited_by":11,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Guelph","funders":"","keywords":"Antimony; Electrophile; Nucleophile; Ab initio; Vinyl chloride; Chemistry; Decomposition; Computational chemistry; Materials science; Organic chemistry; Catalysis","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":[0.0003423669,0.0004254212,0.0006135365,0.0005360635,0.0007833869,0.0005607145,0.0007955119,0.000924357,0.001945533],"category_scores_gemma":[0.0003762925,0.0002886727,0.0004876635,0.0003212049,0.0007615163,0.0006801705,0.0003677645,0.0006011566,0.0002162942],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0007602923,"about_ca_system_score_gemma":0.0004907159,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002875556,"about_ca_topic_score_gemma":0.002404183,"domain_scores_codex":[0.9999049,0.00001915722,0.000004006138,0.000009520592,0.00003452064,0.00002779528],"domain_scores_gemma":[0.9998583,0.00006234532,0.00001723837,0.00001975252,0.00003367219,0.000008614052],"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":[0.0005183295,0.0002399634,0.002515275,0.0008786176,0.00007717216,0.001089614,0.0006216817,0.5710891,0.1513392,0.2486582,0.001729681,0.02124316],"study_design_scores_gemma":[0.00004455289,0.00008819949,0.0006302783,0.00002016644,0.00002171504,0.00007006139,0.00008137648,0.9664601,0.0209523,0.01099212,0.0006232815,0.00001592805],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9672975,0.001219768,0.01869535,0.0005568235,0.00007389169,0.00003486354,0.00006093306,0.000108564,0.01195232],"genre_scores_gemma":[0.9948383,0.0004373023,0.002784213,0.00004677637,0.00001605403,0.00002417609,0.00003435158,0.0000212112,0.001797527],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002875556,"threshold_uncertainty_score":0.00650841,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.06793396082423318,"score_gpt":0.2788040795908275,"score_spread":0.2108701187665943,"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."}}