{"id":"W1746191410","doi":"10.1140/epje/i2015-15039-x","title":"Free energy of formation of small ice nuclei near the Widom line in simulations of supercooled water","year":2015,"lang":"en","type":"article","venue":"The European Physical Journal E","topic":"Material Dynamics and Properties","field":"Materials Science","cited_by":17,"is_retracted":false,"has_abstract":false,"ca_institutions":"Memorial University of Newfoundland; University of Saskatchewan; St. Francis Xavier University","funders":"","keywords":"Supercooling; Metastability; Nucleation; Monte Carlo method; Ice nucleus; Phase transition; Line (geometry); Umbrella sampling; Water model; Liquid water; Thermodynamics; Phase (matter); Physics; Molecular dynamics","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":[0.0009725472,0.0006346533,0.0008462217,0.0009612138,0.001657472,0.001801361,0.001395367,0.00195276,0.003692385],"category_scores_gemma":[0.004382555,0.0007325016,0.0006024956,0.0007628342,0.002326004,0.001654767,0.00129587,0.001350011,0.0002446129],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001528942,"about_ca_system_score_gemma":0.001469714,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.02097359,"about_ca_topic_score_gemma":0.01606594,"domain_scores_codex":[0.9997662,0.00006176697,0.000009986591,0.00002701324,0.00004765213,0.00008735988],"domain_scores_gemma":[0.9983493,0.0009909479,0.0001054835,0.00009359643,0.0001431963,0.0003175401],"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":[0.0007967384,0.0002962685,0.009046121,0.0001138059,0.00008951625,0.0004198334,0.0004206863,0.9615094,0.003575087,0.018408,0.001691571,0.003632976],"study_design_scores_gemma":[0.000159918,0.00008589069,0.002201115,0.00002403143,0.00001832453,0.00002030316,0.000196391,0.9917727,0.001143551,0.004017608,0.0003339889,0.00002614976],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9850691,0.0002286177,0.003501849,0.0006298993,0.00008387738,0.00002850357,0.0002223014,0.0001436656,0.01009222],"genre_scores_gemma":[0.9978459,0.00006235242,0.0008152984,0.00007491637,0.00001132157,0.00002640606,0.0001392115,0.00007616895,0.00094851],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.02097359,"threshold_uncertainty_score":0.04170305,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02978991732667784,"score_gpt":0.2272175721863804,"score_spread":0.1974276548597026,"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."}}