{"id":"W1979708092","doi":"10.1103/physrevlett.95.146403","title":"Fullerene in a Metal-Organic Matrix: Design of the Electronic Structure","year":2005,"lang":"en","type":"article","venue":"Physical Review Letters","topic":"Fullerene Chemistry and Applications","field":"Chemistry","cited_by":16,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal; Regroupement Québécois sur les Matériaux de Pointe","funders":"","keywords":"Fullerene; Materials science; Intermolecular force; Molecule; Crystal (programming language); Crystal structure; Chemical physics; Metal; Density functional theory; Metal-organic framework; Superconductivity; Crystallography; Nanotechnology; Computational chemistry; Condensed matter physics; Physical chemistry; Physics; Chemistry; Organic chemistry; Adsorption","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":[0.00007840416,0.000159707,0.0001895757,0.0001808085,0.0003365441,0.0004296352,0.000250382,0.0004036685,0.001682069],"category_scores_gemma":[0.000131452,0.00009945774,0.0001117472,0.0001491064,0.0002827896,0.0004028875,0.0001954511,0.000242574,0.000173609],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003199699,"about_ca_system_score_gemma":0.0002824598,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007851267,"about_ca_topic_score_gemma":0.001683593,"domain_scores_codex":[0.9999698,0.000004674673,8.953579e-7,0.000005798857,0.00001137583,0.000007403213],"domain_scores_gemma":[0.9999766,0.000008662996,0.000003844441,0.000003258475,0.000002948052,0.000004613022],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.0002037568,0.0002286582,0.001147697,0.0005787467,0.00005126622,0.0008595967,0.0002072683,0.1648326,0.4406463,0.3698181,0.000881939,0.02054416],"study_design_scores_gemma":[0.0003474984,0.000762785,0.001766337,0.00007595019,0.0001025384,0.0008207409,0.000454388,0.7042376,0.2175381,0.04177988,0.032012,0.0001022507],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9534081,0.001489435,0.02456483,0.0004757328,0.00004625714,0.00007228989,0.00008591402,0.0000653415,0.01979201],"genre_scores_gemma":[0.9835887,0.0007890594,0.01391657,0.00002533401,0.000007828517,0.00003599308,0.0000332872,0.00001176238,0.001591527],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001682069,"threshold_uncertainty_score":0.005627096,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009786448451569243,"score_gpt":0.2600758744219639,"score_spread":0.2502894259703947,"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."}}