{"id":"W4386289146","doi":"10.1088/978-0-7503-5321-2ch5","title":"Potential energy surfaces","year":2023,"lang":"en","type":"book-chapter","venue":"","topic":"Advanced Theoretical and Applied Studies in Material Sciences and Geometry","field":"Engineering","cited_by":1,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Lethbridge","funders":"","keywords":"Environmental science; Materials science","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":[0.0007212201,0.001339367,0.001089708,0.001631305,0.001519157,0.002956131,0.002219946,0.002003155,0.06534441],"category_scores_gemma":[0.002505156,0.0005665856,0.001371922,0.001799446,0.0009722901,0.002490046,0.001723168,0.002323264,0.02813692],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001195799,"about_ca_system_score_gemma":0.0007867309,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001273392,"about_ca_topic_score_gemma":0.0007274432,"domain_scores_codex":[0.9991678,0.0001373426,0.00003722822,0.0001130826,0.0004691621,0.00007537863],"domain_scores_gemma":[0.9996248,0.0001573829,0.00001777328,0.00006088548,0.000119871,0.00001918403],"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":[0.00001099139,0.0000209176,0.0001043806,0.0003131294,0.00002242689,0.00007243922,0.00006335555,0.02758165,0.0009694748,0.8957943,0.03138097,0.04366611],"study_design_scores_gemma":[0.00001154318,0.00001618439,0.0001661236,0.0001666813,0.00001324827,0.0001770489,0.00006632924,0.05999134,0.001133913,0.6639203,0.2743029,0.0000345033],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"other","genre_gemma":"other","genre_scores_codex":[0.004811716,0.01624415,0.4473957,0.00336862,0.001763081,0.0001566444,0.002667415,0.001437406,0.5221552],"genre_scores_gemma":[0.1965908,0.03499345,0.4081151,0.002733924,0.001287891,0.00147831,0.009647272,0.006585584,0.3385676],"genre_candidate":"other","genre_consensus":"other","teacher_disagreement_score":0.06534441,"threshold_uncertainty_score":0.2185988,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006011688915080761,"score_gpt":0.1866071433491361,"score_spread":0.1805954544340554,"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."}}