{"id":"W6941166299","doi":"10.1021/jp402421q.s001","title":"Effect of Metal–Support Interface During CH<sub>4</sub> and H<sub>2</sub> Dissociation on Ni/γ-Al<sub>2</sub>O<sub>3</sub>: A Density Functional Theory Study","year":2016,"lang":"en","type":"article","venue":"Figshare","topic":"Mycorrhizal Fungi and Plant Interactions","field":"Agricultural and Biological Sciences","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Waterloo","funders":"","keywords":"Density functional theory; Dissociation (chemistry); Adsorption; Hydrogen; Cluster (spacecraft); Hydrogen atom; Atom (system on chip)","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":[0.0001148036,0.000318776,0.0003075597,0.0001722236,0.0006510665,0.0003921074,0.000637,0.0003341964,0.005766044],"category_scores_gemma":[0.0004080585,0.0001999307,0.0002449873,0.0002311696,0.0003309541,0.0004860867,0.0004295406,0.0006037796,0.0003346753],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004407686,"about_ca_system_score_gemma":0.0003009785,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003632331,"about_ca_topic_score_gemma":0.004627009,"domain_scores_codex":[0.999886,0.000006057998,0.000004631867,0.00001710241,0.00004435079,0.00004185068],"domain_scores_gemma":[0.9998965,0.00004967703,0.00001500807,0.00000997292,0.0000184949,0.00001028426],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.003129801,0.0004732264,0.01262031,0.00475851,0.0002633241,0.002408099,0.002585056,0.05175964,0.8332854,0.03120596,0.01146385,0.04604683],"study_design_scores_gemma":[0.0001586093,0.001506852,0.01900374,0.0001446329,0.0001264826,0.0004293103,0.002609175,0.1731191,0.7905513,0.002898952,0.00930684,0.0001450626],"study_design_candidate":"simulation_or_modeling","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9943196,0.0007213522,0.0005102719,0.0001325377,0.00004867509,0.000009418395,0.0001498921,0.00004993966,0.00405828],"genre_scores_gemma":[0.9987338,0.0003989754,0.0002020062,0.0000283948,0.000004525826,0.00001202329,0.0001450553,0.00000977613,0.0004653951],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005766044,"threshold_uncertainty_score":0.01928931,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01389470502009911,"score_gpt":0.2220482369923381,"score_spread":0.208153531972239,"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."}}