{"id":"W4313535125","doi":"10.1021/acs.jpclett.2c03425","title":"Uncovering the Mechanism of Thermally Activated Delayed Fluorescence in Coplanar Emitters Using Potential Energy Surface Analysis","year":2023,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry Letters","topic":"Organic Light-Emitting Diodes Research","field":"Engineering","cited_by":21,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of British Columbia","funders":"Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs","keywords":"Photochemistry; Fluorescence; Excited state; Phosphorescence; Singlet state; Intramolecular force; Materials science; Acceptor; Quantum efficiency; Chemical physics; Optoelectronics; Chemistry; Atomic physics; Physics; Stereochemistry; Optics","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001075387,0.000195328,0.0001366444,0.0001669642,0.0001262216,0.000375775,0.0002848016,0.000340984,0.00143253],"category_scores_gemma":[0.0001658525,0.0001239552,0.0001556311,0.0001294131,0.0002615417,0.000403701,0.000176779,0.000523142,0.0001795965],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002441022,"about_ca_system_score_gemma":0.0001014174,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001241322,"about_ca_topic_score_gemma":0.0001817088,"domain_scores_codex":[0.9999492,0.000005109999,0.000002328046,0.00001459034,0.0000151059,0.0000135466],"domain_scores_gemma":[0.9999477,0.00002029046,0.00001213536,0.000006228252,0.000009544273,0.000004159273],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.00003651654,0.00002277601,0.0003501692,0.00007478317,0.000008293858,0.00009490459,0.00002860132,0.001491653,0.9893169,0.004044082,0.00005098815,0.004480341],"study_design_scores_gemma":[0.00001084851,0.0001423361,0.0008361799,0.000005544882,0.000008979614,0.0001565143,0.00007120425,0.02181064,0.9744506,0.001410929,0.0010863,0.000009902749],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9712368,0.000407839,0.0252292,0.00009870357,0.00001224729,0.00001892495,0.00006988813,0.00007354246,0.002852826],"genre_scores_gemma":[0.9918961,0.0003156149,0.007025122,0.00001989954,0.000002624026,0.00001915849,0.00005543783,0.00001887222,0.0006472206],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00143253,"threshold_uncertainty_score":0.004792333,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007414676184387804,"score_gpt":0.2220895184992726,"score_spread":0.2146748423148848,"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."}}