{"id":"W2013067639","doi":"10.1063/1.3679875","title":"Cage occupancies in the high pressure structure H methane hydrate: A neutron diffraction study","year":2012,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Methane Hydrates and Related Phenomena","field":"Environmental Science","cited_by":35,"is_retracted":false,"has_abstract":true,"ca_institutions":"Steacie Institute for Molecular Sciences","funders":"U.S. Department of Energy","keywords":"Dodecahedron; Clathrate hydrate; Neutron diffraction; Hydrate; Crystallography; Methane; Chemistry; Rietveld refinement; Ice Ih; Molecule; Powder diffraction; Crystal structure; Materials science; Organic chemistry","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":[0.0001848885,0.0001245595,0.0001903866,0.0003387799,0.0003259631,0.0002140485,0.000309438,0.0002147386,0.00127616],"category_scores_gemma":[0.0003766679,0.0001549029,0.00012445,0.0002761827,0.0003480608,0.0002547365,0.0002578586,0.0001984637,0.00009283327],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004352597,"about_ca_system_score_gemma":0.0002416193,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.005586888,"about_ca_topic_score_gemma":0.005100244,"domain_scores_codex":[0.9998707,0.00001907227,0.000005555803,0.00001945942,0.00005300264,0.00003214632],"domain_scores_gemma":[0.999832,0.0000489107,0.0000316983,0.00001294024,0.00005049434,0.00002385987],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0006796639,0.00006475038,0.02863817,0.0001855842,0.00004882318,0.0004211114,0.0003440019,0.006475353,0.9552983,0.001630532,0.0003289108,0.00588479],"study_design_scores_gemma":[0.0001178176,0.0007922814,0.1985269,0.00004368556,0.00006703127,0.001433837,0.0008587213,0.0395115,0.7505708,0.0009128445,0.00708892,0.00007565115],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.998431,0.000247965,0.0004825272,0.00002707542,0.000002247564,0.000002311956,0.0000737985,0.00001156738,0.0007215571],"genre_scores_gemma":[0.9991446,0.0000982796,0.0004353381,0.000006636807,0.000001311789,0.000002732471,0.0001508351,0.000003504212,0.0001568672],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005586888,"threshold_uncertainty_score":0.01110876,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01091182204411305,"score_gpt":0.2386693569010618,"score_spread":0.2277575348569487,"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."}}