{"id":"W1992580987","doi":"10.1063/1.2982791","title":"A family of model Kohn–Sham potentials for exact exchange","year":2008,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":37,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Kohn–Sham equations; Physics; Mathematical physics; Quantum mechanics; Density functional theory","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":[0.000708939,0.0005220367,0.0007395275,0.0006065383,0.0007937071,0.0009971211,0.001753231,0.0009608365,0.00251291],"category_scores_gemma":[0.001633227,0.0001978266,0.0007167045,0.0005733102,0.0005462845,0.00136867,0.0007019058,0.0008878857,0.0007645885],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005773407,"about_ca_system_score_gemma":0.001014188,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007290564,"about_ca_topic_score_gemma":0.0009548404,"domain_scores_codex":[0.9997266,0.00007003465,0.0000113941,0.000024368,0.0001395205,0.00002797572],"domain_scores_gemma":[0.9996867,0.00008812246,0.00002352862,0.0001048952,0.00006704751,0.00002969317],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"theoretical_or_conceptual","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.00004831613,0.00005649902,0.0003413538,0.0001381928,0.00002296399,0.0001102494,0.00008884984,0.09880564,0.00444716,0.8659885,0.004497803,0.02545452],"study_design_scores_gemma":[0.0000208781,0.00005023412,0.0001407693,0.00002482942,0.000006768438,0.0001761241,0.00003505225,0.6289778,0.001380087,0.361505,0.007654742,0.00002772343],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.1051111,0.002261107,0.8471066,0.001278925,0.0004477099,0.0002888797,0.0007322805,0.0006966543,0.04207662],"genre_scores_gemma":[0.7714151,0.002062063,0.2010169,0.0007160491,0.0001729943,0.0007916597,0.0007567646,0.0002666944,0.02280181],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.00251291,"threshold_uncertainty_score":0.00840652,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04119049354984879,"score_gpt":0.2787294099887409,"score_spread":0.2375389164388921,"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."}}