{"id":"W3049516467","doi":"10.1103/physrevb.103.165406","title":"<i>Ab initio</i> thermoelectric calculations of ring-shaped bands in two-dimensional <mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\"><mml:mrow><mml:msub><mml:mi>Bi</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>Te</mml:mi><mml:mn>3</mml:mn></mml:msub><mml:mo>,</mml:mo><mml:mspace width=\"0.28em\"/><mml:msub><mml:mi>Bi</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>Se</mml:mi><mml:mn>3</mml:mn></mml:msub></mml:mrow></mml:math>, and <mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\"><mml:mrow><mml:msub><mml:mi>Sb</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>Te</mml:mi><mml:mn>3</mml:mn></mml:msub></mml:mrow></mml:math>: Comparison of scattering approximations","year":2021,"lang":"lv","type":"article","venue":"Physical review. B./Physical review. B","topic":"Advanced Thermoelectric Materials and Devices","field":"Materials Science","cited_by":20,"is_retracted":false,"has_abstract":true,"ca_institutions":"Dalhousie University","funders":"Natural Sciences and Engineering Research Council of Canada; Defense Advanced Research Projects Agency","keywords":"Scattering; Thermoelectric effect; Ring (chemistry); Condensed matter physics; Thermoelectric materials; Seebeck coefficient; Physics; Materials science; Molecular physics; Chemistry; Quantum mechanics","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":["metaresearch","metaepi_narrow","metaepi_broad","sts","scholarly_communication","open_science","research_integrity","insufficient_payload"],"consensus_categories":["metaepi_narrow","sts","open_science","research_integrity","insufficient_payload"],"category_scores_codex":[0.009719401,0.005268381,0.002871271,0.003212461,0.007735452,0.006283983,0.01096853,0.008135424,0.6570161],"category_scores_gemma":[0.009461313,0.0104053,0.01008366,0.009525922,0.008801795,0.007490071,0.01040227,0.008554378,0.007988318],"about_ca_system_candidate":true,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001678419,"about_ca_system_score_gemma":0.00845984,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.006413727,"about_ca_topic_score_gemma":0.007776048,"domain_scores_codex":[0.9522805,0.004301481,0.01074553,0.00928323,0.01195102,0.01143823],"domain_scores_gemma":[0.9596504,0.009216824,0.01282363,0.01044078,0.001559709,0.006308633],"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":[0.005625607,0.002880343,0.00005758383,0.01128456,0.00666213,0.004516024,0.004191924,0.004717967,0.02912763,0.3129811,0.6100042,0.007950919],"study_design_scores_gemma":[0.007582465,0.005737019,0.0001545469,0.01138238,0.00957621,0.00502545,0.003248113,0.01562475,0.9140887,0.003029726,0.01544374,0.00910686],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"other","genre_gemma":"empirical","genre_scores_codex":[0.4771405,0.01920522,0.004044672,0.003597573,0.009599631,0.000506148,0.004162421,0.001598483,0.4801453],"genre_scores_gemma":[0.9365976,0.01892447,0.006274053,0.006353388,0.007646738,0.009012043,0.009909673,0.004690802,0.0005912595],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.8849611,"threshold_uncertainty_score":0.9998301,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02307846418465403,"score_gpt":0.2862891227477735,"score_spread":0.2632106585631194,"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."}}