{"id":"W2032353144","doi":"10.1088/1742-6596/377/1/012093","title":"Electron band structure of the high pressure cubic phase of AlH<sub>3</sub>","year":2012,"lang":"en","type":"article","venue":"Journal of Physics Conference Series","topic":"Hydrogen Storage and Materials","field":"Materials Science","cited_by":9,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Saskatchewan","funders":"","keywords":"Condensed matter physics; Electronic band structure; Conductor; Band gap; Local-density approximation; Hybrid functional; Phase (matter); Materials science; Electronic structure; Fermi level; Metal; Density functional theory; Superconductivity; Range (aeronautics); Density of states; Direct and indirect band gaps; Electron; Chemistry; Computational chemistry; Physics; Metallurgy","routes":{"ca_aff":true,"ca_fund":false,"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":[0.0002731073,0.0001557928,0.0004606815,0.00002969078,0.00006678873,0.00003954413,0.0003809195,0.00007394786,0.0001794062],"category_scores_gemma":[0.00005014052,0.00009835048,0.0001129392,0.0001123056,0.0002018886,0.0008288675,0.00006130539,0.0001415251,0.00000261042],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001309846,"about_ca_system_score_gemma":0.0002107367,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001296388,"about_ca_topic_score_gemma":0.000004895025,"domain_scores_codex":[0.9986138,0.0001490401,0.0004934067,0.00009012582,0.0003961993,0.0002574052],"domain_scores_gemma":[0.9982298,0.00003423466,0.001011281,0.0002532419,0.0003944629,0.00007698004],"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":[0.0001578875,0.0001102821,0.00008302506,0.00009728208,0.00004657779,9.523282e-7,0.0009727556,0.00003884428,0.9911294,0.006216771,0.0001309827,0.001015254],"study_design_scores_gemma":[0.0004358316,0.0002571038,0.0002533714,0.00008134801,0.0001341041,0.00003042317,0.00007970044,9.676839e-7,0.9919537,0.006245268,0.0004282483,0.0000998811],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9982122,0.0003082453,0.0003568961,0.0000594292,0.0007948258,0.0001017092,0.0001248292,0.000005230543,0.00003662983],"genre_scores_gemma":[0.9993032,0.00005736718,0.0001367291,0.00001940844,0.000443907,9.30464e-7,0.000002066929,0.00001231481,0.00002412485],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001090946,"threshold_uncertainty_score":0.4010616,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01384706815875222,"score_gpt":0.2505648257767255,"score_spread":0.2367177576179733,"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."}}