{"id":"W2888092795","doi":"10.1063/1.5042755","title":"Atomistic and mesoscale simulation of sodium and potassium adsorption in cement paste","year":2018,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Concrete and Cement Materials Research","field":"Engineering","cited_by":23,"is_retracted":false,"has_abstract":true,"ca_institutions":"Queen's University","funders":"Natural Sciences and Engineering Research Council of Canada; Agence Nationale de la Recherche","keywords":"Mesoscale meteorology; Potassium; Adsorption; Cement; Sodium; Materials science; Chemical engineering; Mineralogy; Environmental science; Composite material; Chemistry; Metallurgy; Geology; Engineering; Organic chemistry; Climatology","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":[0.000313326,0.0003876438,0.0006966256,0.0004205373,0.000878329,0.0006839269,0.001104075,0.001502197,0.002552415],"category_scores_gemma":[0.001453784,0.0004244802,0.0007197559,0.0005335278,0.001096017,0.0004702254,0.0006358548,0.0008885294,0.0001606352],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00202722,"about_ca_system_score_gemma":0.001325074,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.03295996,"about_ca_topic_score_gemma":0.01400857,"domain_scores_codex":[0.9998596,0.00003188792,0.000005799086,0.0000168623,0.00003928454,0.00004645603],"domain_scores_gemma":[0.9992684,0.0003789554,0.00005829558,0.00005268385,0.0000968546,0.0001448877],"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":[0.000168371,0.00011505,0.003763268,0.00003980788,0.00005006014,0.0002079396,0.00007179228,0.989541,0.00229444,0.00245396,0.0003647398,0.0009295783],"study_design_scores_gemma":[0.00003833897,0.00003244754,0.00139015,0.000003707288,0.000006623544,0.0000103477,0.00002824783,0.9977072,0.0002244849,0.0004445788,0.0001061666,0.000007555709],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9902231,0.00007406616,0.002929459,0.0003254746,0.00002336582,0.00003350582,0.0004158929,0.0001144453,0.005860812],"genre_scores_gemma":[0.9969779,0.0000402651,0.001917678,0.00005989907,0.000006907519,0.0000524842,0.0002312851,0.00002999257,0.0006836625],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03295996,"threshold_uncertainty_score":0.06553626,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01521129558200527,"score_gpt":0.2533503990963244,"score_spread":0.2381391035143191,"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."}}