{"id":"W2755803482","doi":"10.1007/s00269-017-0919-9","title":"Empirical electronic polarizabilities: deviations from the additivity rule. I. M2+SO4·nH2O, blödite Na2M2+(SO4)2·4H2O, and kieserite-related minerals with sterically strained structures","year":2017,"lang":"en","type":"article","venue":"Physics and Chemistry of Minerals","topic":"Crystal Structures and Properties","field":"Materials Science","cited_by":5,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Manitoba","funders":"Natural Sciences and Engineering Research Council of Canada; Deutsche Forschungsgemeinschaft","keywords":"Chemistry; Polarizability; Valence (chemistry); Crystallography; Additive function; Ion; Inorganic chemistry; Analytical Chemistry (journal); Molecule; Organic chemistry","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":[0.0001531063,0.0002972389,0.0004277496,0.000006742652,0.0005335016,0.000371414,0.0003818815,0.0001145256,0.0003566609],"category_scores_gemma":[0.0001324984,0.000184182,0.00007244018,0.00004889854,0.0007983521,0.000256392,0.000203994,0.000213687,7.611549e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002377472,"about_ca_system_score_gemma":0.00009076164,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009474338,"about_ca_topic_score_gemma":0.00008016857,"domain_scores_codex":[0.9985298,0.0000581537,0.0003299166,0.0004335058,0.0002817223,0.0003669026],"domain_scores_gemma":[0.9986394,0.0002054909,0.0003497468,0.000572923,0.0001210836,0.000111361],"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":[0.00009560115,0.00003313064,0.001659242,0.00008879032,0.0000649634,0.000001723683,0.000607134,0.0000158496,0.995948,0.0003251731,0.0005787477,0.0005817022],"study_design_scores_gemma":[0.002517016,0.0003851975,0.09014655,0.0002562357,0.000295205,0.00005481625,0.0008448915,0.0004742185,0.7942275,0.1021771,0.007401534,0.001219678],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9960489,0.0006921003,0.00005098846,0.001121243,0.00004147816,0.0001632829,0.0009684764,0.00002725099,0.0008862262],"genre_scores_gemma":[0.9983605,0.00006701262,0.0002748342,0.00009928861,0.000255222,0.00001587968,0.0001005756,0.00002169106,0.0008049686],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.2017204,"threshold_uncertainty_score":0.7510725,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01474088784107844,"score_gpt":0.2447727201836149,"score_spread":0.2300318323425365,"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."}}