{"id":"W4240499795","doi":"10.1002/ange.201607022","title":"Subtle Interactions and Electron Transfer between U<sup>III</sup>, Np<sup>III</sup>, or Pu<sup>III</sup> and Uranyl Mediated by the Oxo Group","year":2016,"lang":"en","type":"article","venue":"Angewandte Chemie","topic":"Lanthanide and Transition Metal Complexes","field":"Materials Science","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Manitoba","funders":"Engineering and Physical Sciences Research Council; Natural Sciences and Engineering Research Council of Canada; University of Edinburgh; European Commission","keywords":"Uranyl; Chemistry; Dication; Crystallography; Actinide; Density functional theory; Electron transfer; NMR spectra database; Molecule; Physical chemistry; Inorganic chemistry; Computational chemistry; Spectral line; Ion","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00006716394,0.000148134,0.0000934306,0.00005389121,0.0001513639,0.0001959159,0.0001974239,0.0001657218,0.001965629],"category_scores_gemma":[0.00009635714,0.0000911788,0.00006278003,0.00003822124,0.0002560721,0.0001715491,0.0002117737,0.0002194657,0.0001543513],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001701034,"about_ca_system_score_gemma":0.00006773059,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003433082,"about_ca_topic_score_gemma":0.0003670928,"domain_scores_codex":[0.9999621,0.000006383161,0.000001287438,0.000006570101,0.000009044916,0.00001454716],"domain_scores_gemma":[0.9999733,0.00001115305,0.000004409715,0.000002894431,0.00000276756,0.000005446077],"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":[0.0001485338,0.00001336234,0.0002480241,0.00004836685,0.000004205001,0.0001046392,0.00008811194,0.0001540497,0.9963068,0.0009515164,0.00005725903,0.00187516],"study_design_scores_gemma":[0.00001832354,0.0002609104,0.002781943,0.000005130753,0.000009586405,0.0001246848,0.0001062867,0.002082968,0.9927742,0.0003592416,0.001470599,0.000005974451],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9984309,0.00008537538,0.0003817355,0.00002019745,0.000004025882,0.000002096125,0.00001052706,0.00001204766,0.001052975],"genre_scores_gemma":[0.9994498,0.00002940911,0.0001623787,0.000008300315,0.000001086249,0.000002067304,0.00001498743,0.000003148519,0.0003288543],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001965629,"threshold_uncertainty_score":0.006575704,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02101887644760601,"score_gpt":0.2503882662998368,"score_spread":0.2293693898522308,"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."}}