{"id":"W4388272418","doi":"10.1021/prechem.3c00082","title":"Catalyzing Singlet Fission by Transition Metals: Second versus Third Row Effects","year":2023,"lang":"en","type":"article","venue":"Precision Chemistry","topic":"Molecular Junctions and Nanostructures","field":"Engineering","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"China Scholarship Council; Canada Foundation for Innovation; Natural Sciences and Engineering Research Council of Canada; Bayerisches Staatsministerium für Wissenschaft und Kunst; Solar Technologies go Hybrid","keywords":"Chemistry; Palladium; Singlet fission; Intersystem crossing; Intramolecular force; Singlet state; Dimer; Photochemistry; Excited state; Triplet state; Population; Platinum; Stereochemistry; Atomic physics; Molecule; 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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001049712,0.0001625372,0.0001487766,0.00004330072,0.00009394824,0.00004584344,0.0001115372,0.0001588735,0.0002930364],"category_scores_gemma":[0.00007723237,0.0001572882,0.00008995317,0.0002809269,0.00001472251,0.00008964298,0.00002744015,0.0001811362,0.00005342314],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004581137,"about_ca_system_score_gemma":0.000007566508,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000001768459,"about_ca_topic_score_gemma":8.977292e-7,"domain_scores_codex":[0.9992309,0.00001440166,0.0001640595,0.0001928023,0.0001921744,0.0002056261],"domain_scores_gemma":[0.9994986,0.0001348777,0.00002154089,0.0002371985,0.00001964529,0.00008813148],"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":[0.00002675829,0.000006835955,0.000001032803,0.0001931322,0.0000330539,0.000008258928,0.0001001116,0.002420957,0.9429713,5.7555e-7,0.04454603,0.009691938],"study_design_scores_gemma":[0.0005606185,0.0000133388,0.00003848428,0.00006549989,0.00002709981,0.000005333686,0.0000363593,0.009376536,0.9646406,0.00007872404,0.02497247,0.000184949],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.987309,0.001157058,0.005873228,0.00004374101,0.0007888087,0.0001147541,0.00004897712,0.0006373065,0.004027159],"genre_scores_gemma":[0.9986251,0.00007208956,0.0002332564,0.00001520706,0.00009689484,0.00002049805,0.0003431561,0.00003775182,0.0005560247],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02166927,"threshold_uncertainty_score":0.6414028,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006669110282720965,"score_gpt":0.2150602083583596,"score_spread":0.2083910980756386,"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."}}