{"id":"W4389741998","doi":"10.1021/acs.jpca.3c07317","title":"Physical Chemistry of Quantum Information Science","year":2023,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry A","topic":"Quantum Computing Algorithms and Architecture","field":"Computer Science","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"The Scarborough Hospital; University of Toronto","funders":"","keywords":"Quantum chemistry; Chemistry; Nanotechnology; Computer science; Data science; Engineering physics; Materials science; Physics; Molecule; Organic 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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006397524,0.0001191031,0.0002195792,0.00003688522,0.0001435862,0.00006518606,0.001663405,0.00002499975,0.000002198675],"category_scores_gemma":[0.0001840214,0.00007452532,0.0001477786,0.001155365,0.0003240039,0.0005382082,0.000370176,0.0003805029,0.00001236158],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000270624,"about_ca_system_score_gemma":0.0002045434,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000001998317,"about_ca_topic_score_gemma":5.691641e-9,"domain_scores_codex":[0.9985961,0.00002209734,0.0002840784,0.00009859265,0.0007488416,0.0002502645],"domain_scores_gemma":[0.9986065,0.0002368993,0.0004088662,0.0003728122,0.0002672389,0.0001077064],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.00001480808,0.00009722382,0.00000217081,0.00009307948,0.00001666769,0.000004439057,0.002976385,0.05292088,0.9366766,0.0007819939,0.0001992382,0.006216513],"study_design_scores_gemma":[0.0001207091,0.00003871333,0.0001008813,0.00003775029,0.00000718309,0.0000444316,0.0000657358,0.6023722,0.3946181,0.002419656,0.0001152389,0.00005936448],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9805741,0.000009203543,0.0181322,0.0005628882,0.00004096747,0.00002823258,0.000002416422,0.00004450206,0.0006055008],"genre_scores_gemma":[0.999355,0.000003414369,0.0001790633,0.00002579897,0.0004143916,4.636329e-7,6.090863e-7,0.000003842955,0.00001747482],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.5494514,"threshold_uncertainty_score":0.3091048,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00762945188222549,"score_gpt":0.2460676670011624,"score_spread":0.2384382151189369,"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."}}