{"id":"W2077202699","doi":"10.1007/s002140100297","title":"Molecular Schr�dinger-Riccati calculations. Test for the hydrogen-ion molecule","year":2001,"lang":"en","type":"article","venue":"Theoretical Chemistry Accounts","topic":"Various Chemistry Research Topics","field":"Chemistry","cited_by":5,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Alberta","funders":"","keywords":"Molecule; Hydrogen molecule; Ion; Function (biology); Riccati equation; Schrödinger equation; Atomic physics; Hydrogen; Sampling (signal processing); Chemistry; Computational chemistry; Physics; Quantum mechanics; Differential equation; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001736968,0.0006241332,0.001797312,0.001291784,0.001609841,0.000593131,0.003474194,0.001491049,0.0270145],"category_scores_gemma":[0.00493953,0.0003222404,0.0008157522,0.00121568,0.0008637629,0.001527033,0.001314347,0.001418538,0.002569165],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006882524,"about_ca_system_score_gemma":0.0009812971,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004126393,"about_ca_topic_score_gemma":0.002929142,"domain_scores_codex":[0.9993086,0.0003144594,0.00002184013,0.00003506782,0.0001858705,0.0001342429],"domain_scores_gemma":[0.9969372,0.001464892,0.0001722641,0.0007174503,0.000549826,0.0001585891],"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":[0.001427599,0.0003975612,0.003276425,0.001034122,0.0002575533,0.000634202,0.0002630309,0.2490662,0.004279396,0.6796349,0.0416225,0.01810648],"study_design_scores_gemma":[0.0007104684,0.0002386942,0.001239628,0.00006476342,0.00006481266,0.00008827577,0.0001550991,0.9105504,0.005388836,0.0791418,0.002317729,0.00003952442],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7854979,0.001223882,0.05403644,0.006368913,0.00113226,0.0004056909,0.006840918,0.003279142,0.1412148],"genre_scores_gemma":[0.9825566,0.000174508,0.01068458,0.0007825056,0.0001526648,0.0002282853,0.001322518,0.0004384908,0.003659869],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0270145,"threshold_uncertainty_score":0.0903725,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01286314520894999,"score_gpt":0.2787980419356582,"score_spread":0.2659348967267082,"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."}}