{"id":"W2969719325","doi":"10.1021/acsomega.9b02050","title":"Simulation on the Factors Affecting the Crystallization Process of FeNi Alloy by Molecular Dynamics","year":2019,"lang":"en","type":"article","venue":"ACS Omega","topic":"nanoparticles nucleation surface interactions","field":"Earth and Planetary Sciences","cited_by":26,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université du Québec à Trois-Rivières","funders":"National Foundation for Science and Technology Development","keywords":"Crystallization; Molecular dynamics; Alloy; Dynamics (music); Materials science; Process (computing); Metallurgy; Computer science; Chemical engineering; Chemistry; Engineering; Physics; Computational 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":[0.0002992167,0.0004970782,0.0006176688,0.0003923465,0.001110131,0.0004391008,0.001110525,0.0009988782,0.007900797],"category_scores_gemma":[0.0006478498,0.0003073238,0.0007378577,0.000455536,0.0003356481,0.0005986654,0.0004595956,0.0009298021,0.0004350877],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008447414,"about_ca_system_score_gemma":0.001396306,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01753301,"about_ca_topic_score_gemma":0.019112,"domain_scores_codex":[0.9999052,0.00002029594,0.00000372015,0.00001609196,0.00002674309,0.00002793891],"domain_scores_gemma":[0.9997991,0.00009036049,0.00001888874,0.00001896918,0.00004218523,0.00003053672],"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":[0.0002508791,0.000281027,0.005258181,0.0003746114,0.0002087694,0.0002371093,0.0002409726,0.919631,0.009868754,0.04441169,0.005976441,0.01326054],"study_design_scores_gemma":[0.00003671908,0.00002229631,0.0004960004,0.000007344427,0.0000137726,0.00001072865,0.0000168425,0.9956453,0.0008461974,0.001302105,0.001594848,0.000007868403],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7841892,0.001323148,0.1549464,0.001532959,0.0004651762,0.000387149,0.006183105,0.001567527,0.04940531],"genre_scores_gemma":[0.8994287,0.0005460846,0.09029895,0.0002535207,0.00004569781,0.0007885817,0.002984425,0.0002901221,0.00536405],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01753301,"threshold_uncertainty_score":0.03486192,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01023829059500515,"score_gpt":0.2378842874292403,"score_spread":0.2276459968342351,"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."}}