{"id":"W2052172245","doi":"10.1021/jp003557+","title":"Electron-Spin Magnetic Moment (<i>g</i> Factor) of X<sup>2</sup>Σ<sup>+</sup> Diatomic Radicals MX<sup>(±)</sup> with Nine Valence Electrons (M = Be, B, Mg, Al; X = N, O, F, P, S, Cl). An ab Initio Study","year":2001,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry A","topic":"Magnetism in coordination complexes","field":"Materials Science","cited_by":47,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of New Brunswick","funders":"","keywords":"Chemistry; Diatomic molecule; Atomic physics; Electron; Magnetic moment; Radical; Spin (aerodynamics); Valence electron; Valence (chemistry); Physics; Condensed matter physics; Nuclear physics; Molecule","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009330497,0.000166699,0.00009347087,0.0002435905,0.000202654,0.0001199508,0.0002466325,0.000178215,0.001712098],"category_scores_gemma":[0.0001847229,0.00008376871,0.00007239013,0.0001585816,0.0002197756,0.0001997857,0.0001126699,0.0001444796,0.0001449924],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002151315,"about_ca_system_score_gemma":0.0000920957,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006874108,"about_ca_topic_score_gemma":0.0007880158,"domain_scores_codex":[0.9999766,0.000005596847,6.985655e-7,0.000003954738,0.000007563649,0.000005569145],"domain_scores_gemma":[0.9999603,0.00001281671,0.00001008685,0.0000058425,0.000006388947,0.000004467019],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.001551428,0.0001728334,0.0230607,0.001240603,0.00009070236,0.0008673847,0.0006632393,0.05158149,0.8218193,0.05237516,0.003211237,0.04336588],"study_design_scores_gemma":[0.0002449466,0.001303819,0.06164603,0.00006874523,0.00008670486,0.0007975778,0.0004915773,0.2878374,0.6279206,0.009100302,0.01044244,0.00005991442],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9957296,0.0003380634,0.0008622577,0.00005690933,0.000005000883,0.000004495203,0.00005747242,0.00002890702,0.002917336],"genre_scores_gemma":[0.9987407,0.0001000331,0.0005529175,0.000008388326,0.000003217999,0.000003386641,0.00007436789,0.000004569749,0.0005124738],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001712098,"threshold_uncertainty_score":0.00572747,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01416535646600983,"score_gpt":0.2708326457574591,"score_spread":0.2566672892914492,"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."}}