{"id":"W2067545032","doi":"10.1021/jp510471k","title":"Far-IR Spectra and Structures of Small Cationic Ruthenium Clusters: Evidence for Cubic Motifs","year":2015,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry C","topic":"Organometallic Complex Synthesis and Catalysis","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"National Research Council Canada","funders":"American Chemical Society Petroleum Research Fund; Max-Planck-Gesellschaft; Deutsche Forschungsgemeinschaft; Alexander von Humboldt-Stiftung","keywords":"Cluster (spacecraft); Dissociation (chemistry); Density functional theory; Infrared spectroscopy; Crystallography; Ruthenium; Spectral line; Absorption spectroscopy; Infrared; Cationic polymerization; Spectroscopy; Chemistry; Atom (system on chip); Materials science; Molecular physics; Computational chemistry; Physical chemistry; Physics; Catalysis; Optics","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002850002,0.000144437,0.0003397759,0.00001409087,0.00004727583,0.00002765135,0.0004394847,0.00004723035,0.0002645516],"category_scores_gemma":[0.0003492148,0.00009487382,0.0001970182,0.00008584843,0.0001494802,0.00008499222,0.00007389551,0.0001806324,9.688407e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006031011,"about_ca_system_score_gemma":0.0001056133,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001189782,"about_ca_topic_score_gemma":0.000001598371,"domain_scores_codex":[0.9991091,0.00001874914,0.000340021,0.000117656,0.0002637615,0.000150644],"domain_scores_gemma":[0.9984204,0.0004928815,0.0004493618,0.0003073025,0.0002029602,0.0001270791],"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":[0.0001496068,0.00007828861,0.00003592118,0.000243584,0.0001428405,6.181924e-7,0.0007826095,0.0001638467,0.9959671,0.00006668713,0.00006625344,0.002302589],"study_design_scores_gemma":[0.0004546187,0.00005406159,0.0001869204,0.00009290237,0.0004257278,0.0000563787,0.0007479293,0.001428563,0.9910366,0.004868295,0.0005196971,0.0001283177],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9972169,0.001141131,0.0003649906,0.0003023997,0.00001666769,0.0000357822,0.00001457545,0.000006545353,0.0009009837],"genre_scores_gemma":[0.9986253,0.00003836551,0.0002118752,0.00001130578,0.0006383777,0.00000177467,0.000002462165,0.00001496738,0.0004556059],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004930567,"threshold_uncertainty_score":0.3868842,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.05232046321508374,"score_gpt":0.2790362822695687,"score_spread":0.2267158190544849,"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."}}