{"id":"W4372295521","doi":"10.3390/modelling4020012","title":"Molecular Dynamics Simulations Correlating Mechanical Property Changes of Alumina with Atomic Voids under Triaxial Tension Loading","year":2023,"lang":"en","type":"article","venue":"Modelling—International Open Access Journal of Modelling in Engineering Science","topic":"Advanced ceramic materials synthesis","field":"Materials Science","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"China Scholarship Council; Government of Canada","keywords":"Nanoporous; Materials science; Composite material; Ceramic; Stiffness; Void (composites); Fracture (geology); Atomic units; Molecular dynamics; Cracking; Tension (geology); Fracture mechanics; Volume fraction; Ultimate tensile strength; Nanotechnology","routes":{"ca_aff":true,"ca_fund":true,"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":[0.0002488927,0.0004798727,0.0004952266,0.0005185078,0.0007100083,0.0005178247,0.000838108,0.001085455,0.002622239],"category_scores_gemma":[0.0008295646,0.0003703686,0.0006598466,0.0006059429,0.0004847742,0.0006045596,0.0003338104,0.0007692563,0.0001471833],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008793129,"about_ca_system_score_gemma":0.0009755823,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.01598208,"about_ca_topic_score_gemma":0.01380586,"domain_scores_codex":[0.9998971,0.00001294019,0.000005951552,0.00001950721,0.00002720142,0.00003728422],"domain_scores_gemma":[0.9996651,0.0001760809,0.00003956182,0.0000205868,0.00005953121,0.00003906319],"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":[0.000199431,0.0001987435,0.004771758,0.0001399672,0.00006467968,0.0002562025,0.0001798125,0.9754791,0.01225565,0.00304019,0.0004947748,0.002919744],"study_design_scores_gemma":[0.00002133801,0.00004502711,0.001068647,0.000006097767,0.000009203281,0.00001082806,0.00004141637,0.9969108,0.001305907,0.0003387132,0.0002321298,0.000009993716],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9913891,0.0001598217,0.003897647,0.00016993,0.00003206186,0.00003426769,0.0006584324,0.000109059,0.003549682],"genre_scores_gemma":[0.9945052,0.0001789775,0.003769595,0.00004275469,0.000007908296,0.00008328385,0.0006401869,0.00003351009,0.0007385577],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01598208,"threshold_uncertainty_score":0.03177816,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.05613847242420843,"score_gpt":0.3273585293663023,"score_spread":0.2712200569420939,"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."}}