{"id":"W2025914935","doi":"10.1063/1.1554735","title":"A finite basis representation Lanczos calculation of the bend energy levels of methane","year":2003,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":90,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"","keywords":"Lanczos resampling; Lanczos algorithm; Parity (physics); Basis function; Legendre polynomials; Wave function; Basis (linear algebra); Physics; Mathematics; Eigenvalues and eigenvectors; Quantum mechanics; Geometry","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001366892,0.0001153389,0.0003078193,0.00001176851,0.00002763752,0.000002955941,0.0002280313,0.00002418096,0.00001952215],"category_scores_gemma":[0.00007600919,0.00006838958,0.0002373841,0.000266542,0.0001586446,0.000108506,0.00005776141,0.0001907963,4.125832e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002047824,"about_ca_system_score_gemma":0.00003865418,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001712064,"about_ca_topic_score_gemma":1.35628e-7,"domain_scores_codex":[0.9989524,0.00009247402,0.0004351324,0.00007234527,0.0003235434,0.0001241408],"domain_scores_gemma":[0.9981418,0.0005103911,0.0007977018,0.0002433143,0.0002748561,0.00003192816],"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":[0.0000518791,0.000164537,0.001091007,0.00001666984,0.0002413926,9.016017e-8,0.0005300199,0.005879213,0.9666699,0.02162808,0.0001759052,0.003551349],"study_design_scores_gemma":[0.000297563,0.00001186845,0.000108383,0.00002484675,0.00009827858,4.996773e-7,0.000091336,0.00008881488,0.7477537,0.2514202,0.00005363047,0.00005078572],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9386429,0.000119745,0.05672429,0.0001605222,0.0001012096,0.00008296914,0.00003381527,0.000003444576,0.004131065],"genre_scores_gemma":[0.9991036,0.000004999402,0.000596138,0.00002357914,0.0002206929,0.000001381167,0.000001972339,0.00001204304,0.00003557058],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2297921,"threshold_uncertainty_score":0.2788846,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0271689493549901,"score_gpt":0.2828976936015959,"score_spread":0.2557287442466059,"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."}}