{"id":"W2030687189","doi":"10.1063/1.4797465","title":"Thermodynamic and kinetic stabilities of CO2 oligomers","year":2013,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Carbon dioxide utilization in catalysis","field":"Chemical Engineering","cited_by":13,"is_retracted":false,"has_abstract":true,"ca_institutions":"Defence Research and Development Canada","funders":"","keywords":"Trimer; Dimer; Dissociation (chemistry); Chemistry; Kinetic energy; Oligomer; Covalent bond; Chemical stability; Thermodynamics; Cluster (spacecraft); Chemical physics; Computational chemistry; Physical chemistry; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001686722,0.0002474661,0.0002100745,0.0002627183,0.0005541404,0.0006534549,0.0002961454,0.0002675772,0.001972704],"category_scores_gemma":[0.0005134658,0.0001753572,0.0001690288,0.0002452918,0.0004160056,0.0004311851,0.0002452801,0.0003729757,0.0001984207],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0007795804,"about_ca_system_score_gemma":0.0003791268,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002155001,"about_ca_topic_score_gemma":0.002560519,"domain_scores_codex":[0.999881,0.000008546477,0.000005344466,0.00004524878,0.00003218825,0.00002758837],"domain_scores_gemma":[0.999842,0.0000500877,0.0000283355,0.00001666403,0.00003290441,0.0000299198],"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":[0.001114667,0.0003383509,0.01514033,0.0004279943,0.0001515542,0.0003815092,0.0005352231,0.2094475,0.7005385,0.04897926,0.00177089,0.02117412],"study_design_scores_gemma":[0.0000552308,0.000516342,0.009804755,0.00002449329,0.00003967169,0.0001767047,0.000338887,0.4046778,0.570322,0.008552247,0.005401798,0.00009001554],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9940491,0.0003774816,0.001734057,0.00006629628,0.00001363529,0.000008273339,0.0001842878,0.00003858025,0.003528275],"genre_scores_gemma":[0.9987448,0.00008626147,0.0004821096,0.000007038767,0.000002940548,0.000009603207,0.0002040466,0.00001245637,0.000450683],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002155001,"threshold_uncertainty_score":0.006599367,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.007626859433380367,"score_gpt":0.2076585901744547,"score_spread":0.2000317307410744,"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."}}