{"id":"W2086026812","doi":"10.1016/s0022-2852(03)00010-9","title":"MRCI studies on the electronic structure of AlN and AlN−, and the electron affinity of AlN","year":2003,"lang":"en","type":"article","venue":"Journal of Molecular Spectroscopy","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":21,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of New Brunswick","funders":"National Energy Research Scientific Computing Center","keywords":"Bohr model; Atomic physics; Materials science; Electron affinity (data page); Electron; Ground state; Multireference configuration interaction; Electronic structure; Configuration interaction; Physics; Condensed matter physics; Molecule; Quantum mechanics; Excited state","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":[0.0006914691,0.0004977059,0.0006418145,0.001066279,0.001392759,0.0005135662,0.001452101,0.0007376152,0.0122101],"category_scores_gemma":[0.001318396,0.0003593337,0.0004734606,0.0009434547,0.0009310977,0.0007255604,0.001049749,0.001271515,0.0009578418],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001097251,"about_ca_system_score_gemma":0.0002101494,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002802206,"about_ca_topic_score_gemma":0.003095175,"domain_scores_codex":[0.999657,0.00005426701,0.00001027119,0.00005542363,0.0001275428,0.00009551171],"domain_scores_gemma":[0.9992433,0.0003920795,0.000125749,0.00009079766,0.0001057202,0.00004236989],"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":[0.002819012,0.0001895605,0.003203761,0.001723457,0.000177673,0.001533066,0.001874177,0.00782892,0.9296747,0.02354243,0.003710147,0.02372323],"study_design_scores_gemma":[0.0001787352,0.0005755141,0.01220484,0.0001576112,0.0001569578,0.001239115,0.0009943243,0.01611391,0.9510409,0.004075739,0.01317904,0.00008326924],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9261572,0.00827663,0.005995854,0.001297308,0.0001180278,0.00003913769,0.0003550519,0.0001569659,0.05760385],"genre_scores_gemma":[0.993491,0.00112921,0.001058947,0.0002038443,0.00003088791,0.00002451422,0.0002273498,0.00002626357,0.003808038],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0122101,"threshold_uncertainty_score":0.04084688,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.005188484987232318,"score_gpt":0.2609993504563651,"score_spread":0.2558108654691328,"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."}}