{"id":"W2021430042","doi":"10.1021/ja003866d","title":"A Theoretical Investigation of the Remarkable Nuclear Spin−Spin Coupling Pattern in [(NC)<sub>5</sub>Pt−Tl(CN)]<sup>-</sup>","year":2001,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Magnetism in coordination complexes","field":"Materials Science","cited_by":57,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Calgary","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Spin (aerodynamics); Coupling (piping); Condensed matter physics; Nuclear magnetic resonance; Physics; Metallurgy","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":[0.001358821,0.0001975318,0.0004684958,0.00003387481,0.0001413331,0.00006916108,0.001093112,0.00008967979,0.0002931845],"category_scores_gemma":[0.0007083332,0.0001247378,0.0004341397,0.0007368645,0.001827288,0.0001778824,0.0003880041,0.0005778209,0.000009261202],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002469607,"about_ca_system_score_gemma":0.0001323441,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0000829226,"about_ca_topic_score_gemma":0.000002642611,"domain_scores_codex":[0.997532,0.0002101936,0.0008354179,0.0002430251,0.0008120774,0.0003673569],"domain_scores_gemma":[0.9976721,0.0004318868,0.001125605,0.0004303117,0.0002183362,0.0001217366],"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":[0.00004504015,0.00006356601,0.01571674,0.00002548728,0.00001514866,0.00000185186,0.000729048,0.001120377,0.9786622,0.0004140347,0.002424465,0.000782067],"study_design_scores_gemma":[0.0008102152,0.000161135,0.025454,0.000322734,0.00006341447,0.00012068,0.0009338993,0.04249566,0.9221883,0.006885147,0.0002806733,0.0002841699],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9920647,0.00004222718,0.0001984951,0.007219327,0.0001571017,0.0001602924,0.000005915447,0.00001700267,0.000134949],"genre_scores_gemma":[0.9966064,0.00008416336,0.001448124,0.00159341,0.0002273258,0.000003702747,5.569261e-7,0.00002750059,0.000008801024],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05647391,"threshold_uncertainty_score":0.6732718,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01076349433633806,"score_gpt":0.2421805890075865,"score_spread":0.2314170946712484,"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."}}