{"id":"W1636257608","doi":"10.1103/physrevb.72.155441","title":"Electronic structure and vibrational properties of<mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\" display=\"inline\"><mml:mrow><mml:msub><mml:mi>Ba</mml:mi><mml:mn>8</mml:mn></mml:msub><mml:msub><mml:mi>Si</mml:mi><mml:mn>46</mml:mn></mml:msub><mml:mo>,</mml:mo><mml:msub><mml:mi>Ba</mml:mi><mml:mn>8</mml:mn></mml:msub><mml:msub><mml:mi>Ag</mml:mi><mml:mi>n</mml:mi></mml:msub><mml:msub><mml:mi>Si</mml:mi><mml:mrow><mml:mn>46</mml:mn><mml:mo>−</mml:mo><mml:mi>n</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math>, and<mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\" display=\"inline\"><mml:mrow><mml:msub><mml:mi>Ba</mml:mi><mml:mn>8</mml:mn></mml:msub><mml:msub><mml:mi>Au</mml:mi><mml:mi>n</mml:mi></mml:msub><mml:msub><mml:mi>Si</mml:mi><mml:mrow><mml:mn>46</mml:mn><mml:mo>−</mml:mo><mml:mi>n</mml:mi></mml:mrow></mml:msub></mml:mrow></mml:math>","year":2005,"lang":"lv","type":"article","venue":"Physical Review B","topic":"Advanced Thermoelectric Materials and Devices","field":"Materials Science","cited_by":41,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Saskatchewan","funders":"RIKEN","keywords":"Raman spectroscopy; Physics; Molecular vibration; Coupling (piping); Crystallography; Materials science; Chemistry; Quantum mechanics","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003502125,0.0007276741,0.0006482911,0.001004599,0.001838637,0.001526605,0.001834328,0.002320378,0.2273754],"category_scores_gemma":[0.0008236789,0.0003645739,0.0004384454,0.001596876,0.0006781201,0.001871258,0.0008660656,0.002388802,0.02586298],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001260172,"about_ca_system_score_gemma":0.0004335945,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004200299,"about_ca_topic_score_gemma":0.006457387,"domain_scores_codex":[0.9996489,0.00002494476,0.000006845517,0.00006933575,0.0001031566,0.0001467509],"domain_scores_gemma":[0.999661,0.000115832,0.00003542937,0.00006989974,0.00007495901,0.0000429629],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001613528,0.0005602672,0.005611864,0.002767436,0.0002472926,0.001200596,0.0013135,0.02897252,0.1425129,0.2316749,0.4952503,0.08827494],"study_design_scores_gemma":[0.0004429544,0.001646423,0.04323983,0.0006128916,0.0001943113,0.0008438703,0.003439868,0.2779395,0.1656243,0.07977753,0.4253147,0.0009237519],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"other","genre_gemma":"empirical","genre_scores_codex":[0.4142839,0.00503501,0.02660279,0.01007577,0.002367614,0.000086076,0.03880603,0.002856487,0.4998864],"genre_scores_gemma":[0.8162931,0.002040302,0.007415486,0.001745628,0.0001601956,0.0003675335,0.04106414,0.001590866,0.1293228],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.2273754,"threshold_uncertainty_score":0.7606463,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01614628748120896,"score_gpt":0.2460856214765947,"score_spread":0.2299393339953857,"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."}}