{"id":"W4310141808","doi":"10.1103/physrevmaterials.6.114602","title":"Engineering coexistence between free and trapped carriers via extrinsic polarons","year":2022,"lang":"en","type":"article","venue":"Physical Review Materials","topic":"ZnO doping and properties","field":"Materials Science","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"McGill University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Delocalized electron; Polaron; Dopant; Materials science; Condensed matter physics; Ab initio; Doping; Electronic structure; Ab initio quantum chemistry methods; Chemical physics; Physics; Quantum mechanics","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006071315,0.0001803063,0.0005575247,0.00002721028,0.0002213575,0.00007480394,0.0003736276,0.00001540154,0.0006589442],"category_scores_gemma":[0.0001650054,0.0001520679,0.00006010884,0.0001257321,0.00006911804,0.0001281704,0.0003701513,0.0000983037,0.00007209352],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003852083,"about_ca_system_score_gemma":0.00002744623,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0000986255,"about_ca_topic_score_gemma":4.44793e-7,"domain_scores_codex":[0.9985638,0.000238586,0.0002978991,0.0003203769,0.0002816326,0.0002977199],"domain_scores_gemma":[0.9992706,0.0001038255,0.0001027545,0.0003915389,0.00002074,0.0001105132],"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":[0.00001014684,0.00001945915,0.00002838833,0.001163036,0.00001115069,0.000003925696,0.0002309322,0.00004412627,0.9966872,0.0005779167,0.0004576507,0.0007660857],"study_design_scores_gemma":[0.0007248828,0.0004410148,0.001921515,0.00167228,0.0003511642,0.00005541711,0.00008162781,0.0003141861,0.9195911,0.0033172,0.07035063,0.001178947],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9893351,0.008901422,0.00003752149,0.0005857595,0.0003477661,0.0003382651,0.0002442187,0.000117798,0.00009214563],"genre_scores_gemma":[0.9983304,0.0007325229,0.0001757958,0.0002862468,0.0002439218,0.0001525549,0.00001507785,0.00002406358,0.0000394728],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.07709605,"threshold_uncertainty_score":0.7214977,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02785418243033867,"score_gpt":0.2688946429249314,"score_spread":0.2410404604945927,"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."}}