{"id":"W3129665236","doi":"10.21203/rs.3.rs-209059/v1","title":"Efficient and Accurate Electronic Structure Simulation Demonstrated on a Trapped-Ion Quantum Computer","year":2021,"lang":"en","type":"preprint","venue":"Research Square","topic":"Quantum Computing Algorithms and Architecture","field":"Computer Science","cited_by":6,"is_retracted":false,"has_abstract":false,"ca_institutions":"QLT (Canada)","funders":"","keywords":"Ion; Electronic structure; Quantum; Computer science; Statistical physics; Atomic physics; Physics; Quantum mechanics","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002948036,0.0002612257,0.000519645,0.000203094,0.0007095477,0.0005217474,0.0007684621,0.0006896792,0.004095661],"category_scores_gemma":[0.001116643,0.0001679617,0.0002059383,0.0003628441,0.0005561533,0.0006475208,0.0003940153,0.0006133638,0.0002658483],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005439916,"about_ca_system_score_gemma":0.0007297015,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004457088,"about_ca_topic_score_gemma":0.003324126,"domain_scores_codex":[0.9998754,0.00003078633,0.000004951315,0.00001428722,0.00005276852,0.00002172655],"domain_scores_gemma":[0.9996341,0.0001666634,0.00001445943,0.00006820409,0.00008596141,0.00003064116],"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":[0.0006245688,0.0002247952,0.002994811,0.0001249182,0.00007632068,0.0004702393,0.0003780891,0.8732455,0.03300725,0.06339973,0.003342408,0.02211141],"study_design_scores_gemma":[0.00002476202,0.00003137799,0.0001597608,0.000001969536,0.000004637973,0.00001162055,0.00001490729,0.993048,0.003650196,0.00258866,0.0004593366,0.000004776422],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8673888,0.0001566884,0.1003358,0.0009419456,0.0001620514,0.00009125472,0.0001849963,0.001516577,0.02922165],"genre_scores_gemma":[0.9719834,0.00003272427,0.02573909,0.00004333955,0.000007570979,0.00003193325,0.00006199402,0.00007894786,0.00202098],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004457088,"threshold_uncertainty_score":0.01370138,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02933279749631821,"score_gpt":0.3412231504762223,"score_spread":0.311890352979904,"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."}}