{"id":"W1591699360","doi":"10.1002/9781118540350.ch14","title":"Computer Simulations of Liquid Silica: Water‐Like Thermodynamic and Dynamic Anomalies, and the Evidence for Polyamorphism","year":2013,"lang":"en","type":"other","venue":"Advances in chemical physics","topic":"Material Dynamics and Properties","field":"Materials Science","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"St. Francis Xavier University; Memorial University of Newfoundland","funders":"","keywords":"Polyamorphism; Tridymite; Tetrahedron; Amorphous silica; Molecular dynamics; Properties of water; Amorphous solid; Chemical physics; Liquid water; Phase (matter); Amorphous ice; Materials science; Thermodynamics; Enthalpy; Chemistry; Cristobalite; Mineralogy; Crystallography; Chemical engineering; Computational chemistry; Organic chemistry; Quartz","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":[0.0001718743,0.0003669603,0.0003830733,0.0003530015,0.0005231079,0.000630757,0.0006630828,0.0007250866,0.003199119],"category_scores_gemma":[0.001102582,0.0002256303,0.0002694493,0.0005391373,0.0007533134,0.0005813274,0.0005461117,0.0005453327,0.0001944284],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006290592,"about_ca_system_score_gemma":0.0005499662,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01082067,"about_ca_topic_score_gemma":0.01278303,"domain_scores_codex":[0.9999316,0.0000160998,0.000002804925,0.000009352131,0.0000234819,0.00001658645],"domain_scores_gemma":[0.9997166,0.0001602923,0.00002722711,0.00001868723,0.0000370514,0.00004021025],"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":[0.0001200334,0.00008809774,0.002730329,0.00007511686,0.00003484185,0.0001312715,0.0001010965,0.9722208,0.002829493,0.01595509,0.00205286,0.003660968],"study_design_scores_gemma":[0.00002994685,0.00001546025,0.0005451688,0.00000886365,0.000004838775,0.000008566294,0.00002113071,0.9941433,0.0004431798,0.003997638,0.0007768292,0.000005092063],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9454259,0.001039003,0.01284651,0.001077503,0.0001128606,0.00003970861,0.001200669,0.0003652372,0.0378927],"genre_scores_gemma":[0.9928434,0.0003246506,0.00405818,0.0001003096,0.00002791489,0.0000626357,0.0005443553,0.000104313,0.00193416],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01082067,"threshold_uncertainty_score":0.02151537,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01342278725463157,"score_gpt":0.2648635560005348,"score_spread":0.2514407687459032,"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."}}