{"id":"W1974689478","doi":"10.1016/j.theochem.2008.12.036","title":"Can periodane accommodate neon?","year":2009,"lang":"en","type":"article","venue":"Journal of Molecular Structure THEOCHEM","topic":"Inorganic Fluorides and Related Compounds","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of New Brunswick","funders":"National Centre for Biological Sciences; Natural Sciences and Engineering Research Council of Canada","keywords":"Neon; Maxima and minima; Molecule; Atomic physics; Perturbation (astronomy); Physics; Density functional theory; Chemistry; Mathematics; Quantum mechanics; Mathematical analysis; Argon","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":[0.00009567819,0.0002181239,0.0003223876,0.00006852878,0.00008164204,0.00006503481,0.0005032019,0.0002094807,0.0007574853],"category_scores_gemma":[0.00003934702,0.0001625037,0.0002228323,0.000125055,0.00004263917,0.00006277713,0.00003722521,0.0007452261,0.000002539461],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007774729,"about_ca_system_score_gemma":0.00009881041,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000002817031,"about_ca_topic_score_gemma":8.709225e-7,"domain_scores_codex":[0.9987944,0.00002241948,0.0004150586,0.0001412944,0.0003566604,0.0002701248],"domain_scores_gemma":[0.9989862,0.0000163556,0.0003506595,0.0003438974,0.0001582552,0.0001446134],"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":[0.00007291106,0.00002587701,0.0000380205,0.00001328755,0.0001238489,0.000493308,0.0003337371,0.0001372487,0.9894058,0.002231365,0.0004583042,0.006666331],"study_design_scores_gemma":[0.000796509,0.0001118872,0.00008516352,0.00007234846,0.0001099874,0.002500091,0.0001577781,0.00005316022,0.9621986,0.03056761,0.003121726,0.0002251068],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9885263,0.001164555,0.0001037489,0.002403367,0.0001905237,0.00002250467,0.000008411964,0.00002413648,0.007556485],"genre_scores_gemma":[0.9980217,0.00004210067,0.0008893075,0.00047139,0.0003316221,1.168565e-7,0.000006437578,0.00002256769,0.0002147747],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02833624,"threshold_uncertainty_score":0.8293933,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00273749983506625,"score_gpt":0.19924411495937,"score_spread":0.1965066151243038,"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."}}