{"id":"W1847414320","doi":"10.1139/v08-081","title":"DFT studies of the σ-donor/π-acceptor properties of [SnCB<sub>10</sub>H<sub>11</sub>]<sup>–</sup> and its relationship to [SnCl<sub>3</sub>]<sup>–</sup>, CO, PF<sub>3</sub>, [SnB<sub>11</sub>H<sub>11</sub>]<sup>2–</sup>, SnC<sub>2</sub>B<sub>9</sub>H<sub>11</sub>, and related SnC<sub>2</sub>B<sub>n</sub>H<sub>n+2</sub> compounds","year":2008,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"Boron Compounds in Chemistry","field":"Medicine","cited_by":13,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Chemistry; Borane; Acceptor; HOMO/LUMO; Cluster (spacecraft); Carbon fibers; Crystallography; Density functional theory; Computational chemistry; Molecule; Catalysis; Organic chemistry; Physics","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaresearch","metaepi_narrow","metaepi_broad","sts","scholarly_communication","open_science","research_integrity","insufficient_payload"],"consensus_categories":["metaepi_narrow","sts","research_integrity"],"category_scores_codex":[0.01262322,0.01724125,0.02000073,0.008127776,0.01028671,0.003521591,0.01258303,0.01300586,0.0002486889],"category_scores_gemma":[0.01478269,0.01825913,0.009186581,0.01468594,0.01599065,0.008080272,0.005805556,0.02157195,0.001438214],"about_ca_system_candidate":true,"about_ca_system_consensus":true,"about_ca_system_score_codex":0.01592673,"about_ca_system_score_gemma":0.02060888,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005862787,"about_ca_topic_score_gemma":0.005724353,"domain_scores_codex":[0.9243395,0.005581285,0.02307521,0.01460099,0.01466492,0.01773814],"domain_scores_gemma":[0.9309053,0.007210085,0.0161101,0.0137915,0.01343125,0.0185518],"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":[0.005677672,0.003975094,0.01480499,0.008942246,0.008105521,0.005701594,0.01072432,0.005948436,0.8578564,0.0001463562,0.06361662,0.01450073],"study_design_scores_gemma":[0.02552913,0.002877687,0.006851252,0.01505827,0.008480124,0.01662228,0.009709475,0.003185624,0.8912842,0.001146191,0.003728337,0.01552742],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9420496,0.02368853,0.0002782306,0.006713093,0.004948079,0.01161605,0.006601677,0.002545986,0.0015588],"genre_scores_gemma":[0.9532645,0.02206271,0.0004425017,0.003721713,0.009046375,0.00252586,0.003504219,0.005199334,0.0002327657],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05988828,"threshold_uncertainty_score":0.9993393,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03189477207462758,"score_gpt":0.2431138016184957,"score_spread":0.2112190295438681,"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."}}