{"id":"W4407945375","doi":"10.1002/smll.202409961","title":"Transition Metal‐Based Perovskite Derivatives for Selective CO <sub>2</sub> Photoreduction: Role of Orbital Occupancy","year":2025,"lang":"en","type":"article","venue":"Small","topic":"Advanced Photocatalysis Techniques","field":"Energy","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Saskatchewan","funders":"","keywords":"Transition metal; Perovskite (structure); Materials science; Photocatalysis; Catalysis; Halide; Delocalized electron; Charge carrier; Photochemistry; Selectivity; Chemical physics; Inorganic chemistry; Chemistry; Crystallography; Optoelectronics; Organic chemistry","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":[0.0001262738,0.0002135993,0.0003569718,0.000232671,0.0001040041,0.00001294088,0.0001527459,0.0001227461,0.00001647555],"category_scores_gemma":[0.00007639278,0.0002238963,0.0002319098,0.0004853107,0.0001220383,0.0001788902,0.00001432953,0.0001226414,0.000004239278],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001102866,"about_ca_system_score_gemma":0.0001056839,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001035325,"about_ca_topic_score_gemma":0.0001583811,"domain_scores_codex":[0.9988588,0.00006757541,0.0003436795,0.0003770257,0.0001178473,0.0002350334],"domain_scores_gemma":[0.9991251,0.0001385396,0.0001489062,0.000293238,0.0002549704,0.00003925723],"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":[0.0003942511,0.000169488,0.00005892047,0.00007947766,0.0001775314,8.297439e-7,0.0005774435,0.0004951413,0.9883772,0.003940398,0.000147079,0.0055822],"study_design_scores_gemma":[0.0005770047,0.0001586328,0.0003099584,0.00005324198,0.0001238367,0.000001754085,0.0003452751,0.0009083221,0.9828665,0.01306284,0.001401082,0.0001915508],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9036292,0.0002119698,0.08947341,0.0000688359,0.00008072793,0.0009325839,0.00009361927,0.0002945072,0.005215171],"genre_scores_gemma":[0.9867161,0.000008639792,0.01217237,0.00009045736,0.00005095915,0.0006414893,0.0002149367,0.00003230746,0.0000727593],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0830869,"threshold_uncertainty_score":0.9130228,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01148771857834205,"score_gpt":0.2674611357472521,"score_spread":0.25597341716891,"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."}}