{"id":"W2769740033","doi":"10.1021/acs.cgd.7b01065","title":"Structural Variations in the Dithiadiazolyl Radicals <i>p</i>-ROC<sub>6</sub>F<sub>4</sub>CNSSN (R = Me, Et, <sup><i>n</i></sup>Pr, <sup><i>n</i></sup>Bu): A Case Study of Reversible and Irreversible Phase Transitions in <i>p</i>-EtOC<sub>6</sub>F<sub>4</sub>CNSSN","year":2017,"lang":"en","type":"article","venue":"Crystal Growth & Design","topic":"Organic and Molecular Conductors Research","field":"Materials Science","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Windsor","funders":"Engineering and Physical Sciences Research Council; Canada Research Chairs; Ministerio de Economía y Competitividad; University of Windsor","keywords":"Radical; Chemistry; Physics; Crystallography","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":["metaepi_narrow","sts","scholarly_communication"],"consensus_categories":["metaepi_narrow"],"category_scores_codex":[0.005767796,0.001762696,0.002202709,0.001468864,0.002721841,0.001414486,0.002714305,0.000963246,0.00006231818],"category_scores_gemma":[0.001985951,0.001659209,0.0006212943,0.002340708,0.001794757,0.003028279,0.0009784154,0.002265253,0.0001118296],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005903193,"about_ca_system_score_gemma":0.00192839,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007595514,"about_ca_topic_score_gemma":0.00125573,"domain_scores_codex":[0.985192,0.003811634,0.002619386,0.002884242,0.002655605,0.002837134],"domain_scores_gemma":[0.9920084,0.001848246,0.001119679,0.003039278,0.0007511111,0.001233243],"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":[0.0008161732,0.002086837,0.0004717363,0.0003786386,0.0002573052,0.003746378,0.01564667,0.00173312,0.9701647,0.0004741439,0.002207918,0.002016375],"study_design_scores_gemma":[0.01305647,0.001953508,0.0009445713,0.0004233654,0.000725934,0.001962555,0.01018643,0.00739842,0.9593675,0.001903209,0.00009332715,0.001984773],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9837305,0.0007207999,0.006881635,0.0010744,0.0004269115,0.005783353,0.0009439483,0.0002482827,0.0001901955],"genre_scores_gemma":[0.9963793,0.0007260488,0.0006837345,0.0006619609,0.0003740261,0.0006842432,0.0001725306,0.0003030963,0.00001510101],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01264878,"threshold_uncertainty_score":0.9996222,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03382715878732394,"score_gpt":0.2852839542153792,"score_spread":0.2514567954280553,"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."}}