{"id":"W7020675760","doi":"","title":"Modeling Zirconium Under Neutron Irradiation: Interatomic Potentials, Displacement Cascades, and Electron-Ion Coupling","year":2025,"lang":"en","type":"dissertation","venue":"QSpace (Queen's University Library)","topic":"Nuclear Materials and Properties","field":"Materials Science","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Embedded atom model; Molecular dynamics; Neutron; Atom (system on chip); Coupling (piping); Anisotropy; Displacement (psychology); Diffusion; Neutron flux","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":false,"about_ca":true,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.00009248444,0.0003925986,0.0004419956,0.0002871184,0.0004404864,0.0004903615,0.0003547405,0.0003392223,0.0005843934],"category_scores_gemma":[0.000006464275,0.0004148775,0.00009711163,0.000162404,0.00003846924,0.00122214,0.0001946758,0.0002905763,0.00004824594],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001788096,"about_ca_system_score_gemma":0.0003182993,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003898553,"about_ca_topic_score_gemma":0.0001452773,"domain_scores_codex":[0.9983122,0.0001131523,0.0002668224,0.0006550754,0.0002365543,0.0004161831],"domain_scores_gemma":[0.9993023,0.00003181189,0.0001886547,0.0002939707,0.00005934837,0.0001239449],"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":[0.01071172,0.0004956241,0.0002347784,0.005663976,0.0007523159,0.0002194753,0.006581325,0.1360221,0.6986101,0.03838871,0.1019313,0.0003887178],"study_design_scores_gemma":[0.00385297,0.0007917847,0.002637707,0.00400616,0.001240431,0.000003930495,0.01744992,0.02136468,0.8690646,0.001674052,0.07369827,0.004215535],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9910926,0.0003089618,0.0002304005,0.00548919,0.001148386,0.000408815,0.00007306071,0.0002507133,0.0009978488],"genre_scores_gemma":[0.926671,0.001365917,0.0003761706,0.0001251554,0.0001701179,0.000002674091,0.0006914811,0.00006371414,0.07053374],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1704545,"threshold_uncertainty_score":0.9998303,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00702894054544205,"score_gpt":0.1979603027289114,"score_spread":0.1909313621834693,"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."}}