{"id":"W2019885197","doi":"10.1063/1.2753483","title":"Accuracy of recent potential energy surfaces for the He–N2 interaction. I. Virial and bulk transport coefficients","year":2007,"lang":"en","type":"article","venue":"The Journal of Chemical Physics","topic":"Quantum, superfluid, helium dynamics","field":"Physics and Astronomy","cited_by":30,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Waterloo","funders":"Ministère de la Transition écologique et Solidaire; University of Waterloo","keywords":"Ab initio; Virial coefficient; Ab initio quantum chemistry methods; Chemistry; Coulomb; Potential energy surface; Potential energy; Virial theorem; Pair potential; Thermodynamics; Atomic physics; Physics; Quantum mechanics","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":[0.001850805,0.0007101416,0.0007411054,0.001274249,0.0006953339,0.0009868349,0.002350316,0.001173349,0.001451284],"category_scores_gemma":[0.004597218,0.0003803029,0.000885019,0.0008064313,0.0006239084,0.001461626,0.001087567,0.0009426546,0.0003888182],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0009784801,"about_ca_system_score_gemma":0.0004565846,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002160398,"about_ca_topic_score_gemma":0.001803768,"domain_scores_codex":[0.9993319,0.0001976485,0.00003493295,0.00006659079,0.0003141526,0.00005481414],"domain_scores_gemma":[0.9988061,0.0005250831,0.00006480329,0.0002995868,0.0002729273,0.0000315463],"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":[0.0003300246,0.0001226441,0.00346454,0.0005841111,0.0001566745,0.0001772962,0.0002343332,0.7570333,0.03211839,0.1516693,0.002800075,0.05130929],"study_design_scores_gemma":[0.00002620504,0.00004708507,0.00147835,0.00003089976,0.00001468661,0.00006334466,0.00003432926,0.9597627,0.01406991,0.0221891,0.002251144,0.00003220853],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.6338649,0.007754303,0.3144701,0.0008242916,0.0002862265,0.00007044456,0.001142297,0.002034435,0.03955306],"genre_scores_gemma":[0.965282,0.001180906,0.0291765,0.00006736189,0.00004807265,0.00007971618,0.001007071,0.0003200803,0.002838359],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002350316,"threshold_uncertainty_score":0.009788096,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01274190896062994,"score_gpt":0.2672563781348009,"score_spread":0.2545144691741709,"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."}}