{"id":"W2319008948","doi":"10.1139/v11-068","title":"A theoretical investigation of tetrahydroquinoline dyes with different spacers used for sensitized solar cells","year":2011,"lang":"en","type":"article","venue":"Canadian Journal of Chemistry","topic":"TiO2 Photocatalysis and Solar Cells","field":"Energy","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Chemistry; Moiety; Density functional theory; Time-dependent density functional theory; Thiophene; Absorption spectroscopy; Excited state; Absorption (acoustics); Photochemistry; Electron transfer; Atomic electron transition; Electron donor; Electron acceptor; Dye-sensitized solar cell; Solvent effects; Semiconductor; Band gap; Solvent; Computational chemistry; Spectral line; Physical chemistry; Electrode; Electrolyte; Stereochemistry; Organic chemistry; Atomic physics; Optoelectronics; Materials science; Catalysis","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":true,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000171582,0.0001416212,0.0003291898,0.00007567754,0.00004446608,0.0000182963,0.0001557744,0.0001148828,0.0006000397],"category_scores_gemma":[0.00004352047,0.0001090007,0.0001561384,0.00009090819,0.0002660971,0.00005206144,0.000004772764,0.0001643652,9.905475e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00007716916,"about_ca_system_score_gemma":0.0004794908,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001020299,"about_ca_topic_score_gemma":0.002667819,"domain_scores_codex":[0.9991188,0.00002608421,0.000359691,0.000115517,0.0001462673,0.0002336401],"domain_scores_gemma":[0.9987143,0.00005321712,0.0002842532,0.0001888661,0.0002145869,0.000544743],"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":[0.0001837794,0.00003189791,0.001426177,0.0001516689,0.0002633315,0.0000800225,0.004531125,0.0001232966,0.9913459,0.001387364,0.0002922006,0.000183268],"study_design_scores_gemma":[0.0008910876,0.00009669842,0.0001837932,0.00008851209,0.0001061009,0.00004757016,0.0008038596,0.0002029475,0.9959626,0.001142739,0.0003410794,0.0001330755],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9976617,0.00007067555,0.0003669551,0.00008720664,0.00004901412,0.00007827175,0.00002315656,0.000004086961,0.001659001],"genre_scores_gemma":[0.9989696,0.000007024812,0.0007612273,0.0000360201,0.00009718487,0.000002355339,0.00001287692,0.00002344369,0.00009028291],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004616667,"threshold_uncertainty_score":0.6570014,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01176284476484581,"score_gpt":0.1836948763097081,"score_spread":0.1719320315448623,"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."}}