{"id":"W2081364875","doi":"10.1016/j.jqsrt.2014.08.028","title":"Improved direct potential fit analyses for the ground electronic states of the hydrogen halides: HF/DF/TF, HCl/DCl/TCl, HBr/DBr/TBr and HI/DI/TI","year":2014,"lang":"en","type":"article","venue":"Journal of Quantitative Spectroscopy and Radiative Transfer","topic":"Atmospheric Ozone and Climate","field":"Earth and Planetary Sciences","cited_by":81,"is_retracted":false,"has_abstract":false,"ca_institutions":"Dalhousie University","funders":"","keywords":"Isotopologue; Halide; Hydrogen halide; Potential energy; Atomic physics; Ground state; Rotational–vibrational spectroscopy; Physics; Chemistry; Materials science; Molecule; Excited state; 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":[0.0005821274,0.0006858687,0.0005013018,0.0008212348,0.0006107518,0.0005527284,0.001272638,0.0007006864,0.0213679],"category_scores_gemma":[0.001745039,0.0002602385,0.0007577715,0.0008363604,0.0002019358,0.0007969901,0.0007750959,0.0006732688,0.001231313],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005273085,"about_ca_system_score_gemma":0.0005026277,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004991943,"about_ca_topic_score_gemma":0.01025464,"domain_scores_codex":[0.9998273,0.00005607014,0.00000679391,0.0000166419,0.00006224388,0.00003096407],"domain_scores_gemma":[0.9992619,0.0003757435,0.00003261434,0.0001099737,0.0001945604,0.00002521169],"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":[0.00121515,0.0003429442,0.005301353,0.0005589292,0.0003627373,0.000607094,0.0002598625,0.8352661,0.02131066,0.0472526,0.01316197,0.0743606],"study_design_scores_gemma":[0.00007363687,0.00006961122,0.001422065,0.00001230919,0.00003314035,0.00006222735,0.00006376667,0.9874541,0.004062463,0.00539038,0.001334102,0.00002224577],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.7603965,0.0007867716,0.1865278,0.0005332567,0.0001142839,0.0001261457,0.005248842,0.004082056,0.0421843],"genre_scores_gemma":[0.9747917,0.0001049814,0.01554102,0.0000834337,0.00002275388,0.00009028029,0.002115702,0.0005555697,0.006694484],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0213679,"threshold_uncertainty_score":0.07148278,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02540296800431638,"score_gpt":0.2940682144982152,"score_spread":0.2686652464938988,"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."}}