{"id":"W2080392531","doi":"10.1103/physrevb.67.155404","title":"Raman scattering in<mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\" display=\"inline\"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant=\"normal\">C</mml:mi></mml:mrow><mml:mrow><mml:mn>60</mml:mn></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:mrow><mml:mi mathvariant=\"normal\">C</mml:mi></mml:mrow><mml:mrow><mml:mn>48</mml:mn></mml:mrow></mml:msub></mml:mrow><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant=\"normal\">N</mml:mi></mml:mrow><mml:mrow><mml:mn>12</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>aza-fullerene:  First-principles study","year":2003,"lang":"lv","type":"article","venue":"Physical review. B, Condensed matter","topic":"Fullerene Chemistry and Applications","field":"Chemistry","cited_by":22,"is_retracted":false,"has_abstract":true,"ca_institutions":"Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Raman spectroscopy; Ab initio; Degenerate energy levels; Raman scattering; Density functional theory; Physics; Basis (linear algebra); Crystallography; Chemistry; Quantum mechanics; Mathematics; Geometry","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","open_science","research_integrity","insufficient_payload"],"consensus_categories":["metaepi_narrow","sts","open_science","research_integrity","insufficient_payload"],"category_scores_codex":[0.007727979,0.004516895,0.001720902,0.00234345,0.006421988,0.007168052,0.01052566,0.009507752,0.9588674],"category_scores_gemma":[0.007144568,0.009680373,0.008476671,0.005485782,0.007518227,0.006325345,0.009987813,0.008575152,0.01254725],"about_ca_system_candidate":true,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00009443935,"about_ca_system_score_gemma":0.006949675,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.005385517,"about_ca_topic_score_gemma":0.006593566,"domain_scores_codex":[0.9605037,0.002414839,0.008663833,0.008113777,0.009637006,0.01066686],"domain_scores_gemma":[0.9660878,0.006976624,0.009569723,0.01070632,0.0008837435,0.005775834],"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":[0.005204186,0.002075706,0.00007117866,0.00924403,0.007195256,0.008033594,0.004237426,0.003265097,0.0126365,0.240589,0.7051451,0.002302985],"study_design_scores_gemma":[0.007601413,0.003736175,0.0003793798,0.007658816,0.008166357,0.008388357,0.005362023,0.02677015,0.9047484,0.0001479498,0.01876722,0.008273697],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"other","genre_gemma":"empirical","genre_scores_codex":[0.2903143,0.004856852,0.001154051,0.002609898,0.005785804,0.0001745212,0.002008078,0.0008825246,0.692214],"genre_scores_gemma":[0.9449876,0.008771181,0.004337472,0.007335513,0.008185295,0.00997136,0.009293322,0.004767265,0.002350969],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.9463202,"threshold_uncertainty_score":0.99868,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01971356370779732,"score_gpt":0.2541576108009439,"score_spread":0.2344440470931466,"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."}}