{"id":"W1995856213","doi":"10.1063/1.3585677","title":"A perturbative density functional theory for square-well fluids","year":2011,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Phase Equilibria and Thermodynamics","field":"Engineering","cited_by":29,"is_retracted":false,"has_abstract":true,"ca_institutions":"Honeywell (Canada)","funders":"National Energy Research Scientific Computing Center; Energy Foundation; U.S. Department of Energy; National Science Foundation","keywords":"Range (aeronautics); Square (algebra); Work (physics); Density functional theory; Statistical physics; Quadratic equation; Physics; Measure (data warehouse); Perturbation theory (quantum mechanics); Correlation function (quantum field theory); Function (biology); Radial distribution function; Classical mechanics; Thermodynamics; Mathematics; Materials science; Quantum mechanics; Molecular dynamics; Geometry","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002198452,0.0001016128,0.000151876,0.00001192636,0.00002559365,0.000005196063,0.0001635671,0.00004326834,0.00003479079],"category_scores_gemma":[0.00002816954,0.00006656203,0.0001407785,0.00005535687,0.00006730616,0.0001159146,0.00001858101,0.0002069375,0.00000697043],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004035838,"about_ca_system_score_gemma":0.00002086525,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":3.627349e-7,"about_ca_topic_score_gemma":4.606737e-8,"domain_scores_codex":[0.9995037,0.00002437207,0.000175844,0.00004074294,0.0001245472,0.0001307963],"domain_scores_gemma":[0.9994168,0.0002528168,0.00006025675,0.0001079362,0.0001069121,0.00005531785],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0008295912,0.0001201425,0.00001763839,0.00003638351,0.0003298836,0.000002282251,0.001897427,0.0006121263,0.968608,0.02388563,0.001595558,0.002065357],"study_design_scores_gemma":[0.0006285682,0.00008336216,0.00008803734,0.00002203871,0.0001737786,0.00004019733,0.00008139422,0.02583674,0.5796239,0.39311,0.0001727744,0.0001392215],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7737794,0.0001221252,0.2222658,0.0000184728,0.0002653775,0.0000645126,0.000005750346,0.00002594949,0.003452647],"genre_scores_gemma":[0.9988823,0.000009050967,0.0004889737,0.00005745977,0.0005109707,0.000001364789,0.000002373387,0.00002163531,0.00002588755],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.3889841,"threshold_uncertainty_score":0.2714321,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02091643333814093,"score_gpt":0.2040677717249903,"score_spread":0.1831513383868494,"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."}}