{"id":"W2745757791","doi":"10.1063/1.4998701","title":"Thermodynamic hardness and the maximum hardness principle","year":2017,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":35,"is_retracted":false,"has_abstract":true,"ca_institutions":"McMaster University","funders":"Natural Sciences and Engineering Research Council of Canada; Consejo Nacional de Ciencia y Tecnología","keywords":"Thermodynamics; Chemical stability; Formalism (music); Zero (linguistics); Charge (physics); Electron; Second derivative; Effective nuclear charge; Chemistry; Physics; Quantum mechanics; Mathematics; Mathematical analysis","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002933622,0.0001988018,0.0004006953,0.000006038925,0.0004393514,0.00008918902,0.0009310824,0.00002638594,0.00001129172],"category_scores_gemma":[0.00004478217,0.00009889053,0.0001926433,0.00004039187,0.001104836,0.000274387,0.0004345026,0.0005164715,0.000005681666],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000237958,"about_ca_system_score_gemma":0.00003122752,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001485152,"about_ca_topic_score_gemma":1.070746e-7,"domain_scores_codex":[0.9990056,0.00004772254,0.0003062167,0.0001139352,0.0002856845,0.0002408902],"domain_scores_gemma":[0.9982504,0.0002075176,0.0007209498,0.0005751284,0.00017395,0.00007205426],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.002372839,0.0009014735,0.005416436,0.0001355189,0.002493003,0.000007494004,0.005114682,0.0003115288,0.5665243,0.3233048,0.003601533,0.08981632],"study_design_scores_gemma":[0.001940537,0.00001451423,0.0003374444,0.00004920005,0.0001931178,0.000005143558,0.0001945786,0.0003892321,0.08968671,0.9063355,0.0006793772,0.0001746731],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9805018,0.0001791021,0.008672858,0.00168904,0.0003682658,0.0001702322,0.00001386915,0.000009426441,0.008395402],"genre_scores_gemma":[0.9984884,0.00002039199,0.0001223369,0.00007096671,0.001130041,0.000005037373,0.000001308739,0.0000239749,0.0001375065],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.5830306,"threshold_uncertainty_score":0.4070815,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01331178718010835,"score_gpt":0.2718475399804727,"score_spread":0.2585357528003644,"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."}}