{"id":"W4387230619","doi":"10.21105/joss.05115","title":"The Generalized Green’s function Cluster Expansion: APython package for simulating polarons","year":2023,"lang":"en","type":"article","venue":"The Journal of Open Source Software","topic":"Physics of Superconductivity and Magnetism","field":"Physics and Astronomy","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of British Columbia","funders":"Brookhaven National Laboratory; U.S. Department of Energy; Advanced Scientific Computing Research; Flatiron Health; Natural Sciences and Engineering Research Council of Canada; Materials Research Science and Engineering Center, Harvard University; Division of Materials Research; Office of Science; Stewart Blusson Quantum Matter Institute, University of British Columbia; Gordon and Betty Moore Foundation; Simons Foundation; National Science Foundation","keywords":"Python (programming language); Polaron; Cluster (spacecraft); Physics; Mathematics; Computer science; Mathematical physics; Computer graphics (images); Programming language; Nuclear physics","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":[0.0008527917,0.001128923,0.001307516,0.0005421671,0.0008268696,0.0009585402,0.003447177,0.001355467,0.03852883],"category_scores_gemma":[0.002311297,0.0005344347,0.001106766,0.001111531,0.0005345423,0.001081608,0.001472592,0.002297437,0.006865019],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008113493,"about_ca_system_score_gemma":0.001893465,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00958951,"about_ca_topic_score_gemma":0.01040189,"domain_scores_codex":[0.9996027,0.0001101311,0.00001344482,0.00003176753,0.0001618539,0.00008004122],"domain_scores_gemma":[0.9992703,0.0003398686,0.00003835768,0.00009453359,0.0001782525,0.00007877318],"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":[0.0003163438,0.0002884761,0.002150043,0.001122525,0.0002775903,0.0006350645,0.000422406,0.5407261,0.008218977,0.1627551,0.2068492,0.0762381],"study_design_scores_gemma":[0.0001623533,0.00003326332,0.0003722172,0.0000484481,0.00002514605,0.00007095194,0.00003937029,0.9232548,0.002527284,0.02617106,0.0472554,0.0000397421],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"methods","genre_gemma":"software","genre_scores_codex":[0.03929972,0.0008816862,0.8319945,0.0009658085,0.0007430188,0.0006404954,0.01709042,0.03709497,0.0712894],"genre_scores_gemma":[0.1587937,0.0008328811,0.77029,0.0006949349,0.0002099313,0.003170172,0.0146011,0.02739542,0.02401194],"genre_candidate":"software","genre_consensus":null,"teacher_disagreement_score":0.03852883,"threshold_uncertainty_score":0.1288918,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03341206567422056,"score_gpt":0.294361547299116,"score_spread":0.2609494816248955,"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."}}