{"id":"W2801045624","doi":"10.3390/molecules23040931","title":"Direct (Hetero)Arylation for the Synthesis of Molecular Materials: Coupling Thieno[3,4-c]pyrrole-4,6-dione with Perylene Diimide to Yield Novel Non-Fullerene Acceptors for Organic Solar Cells","year":2018,"lang":"en","type":"article","venue":"Molecules","topic":"Organic Electronics and Photovoltaics","field":"Engineering","cited_by":37,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Calgary","funders":"Natural Sciences and Engineering Research Council of Canada; Western Canada Research Grid; Compute Canada; Canada First Research Excellence Fund; University of Calgary","keywords":"Perylene; Diimide; Yield (engineering); Organic solar cell; Pyrrole; Fullerene; Chemistry; Materials science; Photochemistry; Organic chemistry; Molecule; Polymer","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":[0.0002853393,0.0002705335,0.0003356809,0.0001035263,0.0001604623,0.00006694802,0.0003033342,0.0001181356,0.00006505453],"category_scores_gemma":[0.0001239835,0.000209939,0.00008859968,0.0002473459,0.00003926318,0.00006179096,0.00004745142,0.00007352731,0.00000765794],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006023036,"about_ca_system_score_gemma":0.00004235677,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00005541211,"about_ca_topic_score_gemma":0.00009600238,"domain_scores_codex":[0.9987805,0.000007673646,0.000322871,0.0002892794,0.0001856688,0.0004140124],"domain_scores_gemma":[0.998945,0.0003387636,0.00008966439,0.0003946273,0.0001615635,0.00007038374],"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":[0.0001217537,0.00003248847,0.000005611221,0.000111869,0.0001662902,3.903992e-7,0.0002114927,0.008501962,0.9903349,0.0000304826,0.0002138677,0.0002689504],"study_design_scores_gemma":[0.0002575983,0.000372402,0.00005410274,0.0001303343,0.0001262621,0.000001691516,0.00006393284,0.01743928,0.9807803,0.0000220846,0.000479366,0.0002726655],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6768054,0.0001751605,0.3216777,0.00009546557,0.000211076,0.0007839258,0.000131655,0.00007543246,0.00004414494],"genre_scores_gemma":[0.9944921,0.00008534489,0.004806443,0.00008012319,0.0001476224,0.0002165316,0.00001468453,0.0001393715,0.00001773621],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.3176867,"threshold_uncertainty_score":0.8561065,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00847618045941218,"score_gpt":0.1985299864048359,"score_spread":0.1900538059454237,"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."}}