{"id":"W4232521411","doi":"10.1149/ma2009-02/39/2984","title":"Ab Initio Study of Stability and Site-Specific Adsorption Energies of Pt Nanoparticles","year":2009,"lang":"en","type":"article","venue":"ECS Meeting Abstracts","topic":"Chemical and Physical Properties of Materials","field":"Materials Science","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"Simon Fraser University","funders":"","keywords":"Adsorption; Ab initio; Stability (learning theory); Nanoparticle; Computational chemistry; Materials science; Chemistry; Physical chemistry; Nanotechnology; Computer science; Organic chemistry; Machine learning","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":[0.0003768295,0.0004928445,0.0009925417,0.0005373522,0.0009429592,0.0005199277,0.001262949,0.001028129,0.007549402],"category_scores_gemma":[0.000651834,0.0003960136,0.0006445119,0.0005270143,0.0003537781,0.0006129985,0.0004461108,0.0007594451,0.0009760974],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001047343,"about_ca_system_score_gemma":0.0005691788,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.007112009,"about_ca_topic_score_gemma":0.008195848,"domain_scores_codex":[0.9998267,0.00002955899,0.000005017828,0.00001809912,0.00008090311,0.00003965873],"domain_scores_gemma":[0.9997488,0.000110198,0.00001351661,0.00004115366,0.00006993075,0.00001642835],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.001683544,0.0006870491,0.004642323,0.003268121,0.0005219534,0.001353791,0.0005355841,0.5640945,0.2313726,0.1347397,0.01794687,0.03915396],"study_design_scores_gemma":[0.0001349875,0.0001398482,0.002357076,0.00005207692,0.00005631562,0.0000881799,0.0001000877,0.9558968,0.03347581,0.005808634,0.001856508,0.00003358381],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9361586,0.002202605,0.01779952,0.0009021783,0.0002632095,0.00009834481,0.001603487,0.0005875493,0.04038444],"genre_scores_gemma":[0.9894083,0.0005368254,0.004926417,0.00009165428,0.00005188319,0.00009419,0.0007281442,0.00009015496,0.0040725],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007549402,"threshold_uncertainty_score":0.02525526,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03513960784344446,"score_gpt":0.2424752060331639,"score_spread":0.2073355981897194,"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."}}