{"id":"W1985232086","doi":"10.1021/jp0619890","title":"Rotational Spectroscopic and ab Initio Studies of the Xe−H<sub>2</sub>O van der Waals Dimer","year":2006,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry A","topic":"Atmospheric Ozone and Climate","field":"Earth and Planetary Sciences","cited_by":42,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta","funders":"","keywords":"van der Waals force; Dimer; Ab initio; Van der Waals strain; Ab initio quantum chemistry methods; Chemistry; Computational chemistry; Van der Waals radius; Atomic physics; Crystallography; Physics; Molecule; 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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001221333,0.00008058701,0.0001687945,0.000001824743,0.0001000789,0.00001067903,0.0001370171,0.00001852568,0.0001017732],"category_scores_gemma":[0.00003010913,0.00003897525,0.00007082618,0.00008397297,0.0002226894,0.00007691381,0.00001466471,0.0001511436,0.000006490929],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00000361886,"about_ca_system_score_gemma":0.00003244396,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001798896,"about_ca_topic_score_gemma":0.000008045081,"domain_scores_codex":[0.999365,0.00003845862,0.0001946811,0.00005352012,0.0002371787,0.0001112187],"domain_scores_gemma":[0.9993695,0.0002399106,0.0002194344,0.00007855432,0.00006246212,0.00003016547],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00008424035,0.00009558629,0.01747299,0.00009287649,0.0001737134,0.00000538001,0.0006985532,0.004916807,0.9741133,0.00005473061,0.0008667409,0.001425094],"study_design_scores_gemma":[0.0003840546,0.00009669689,0.1490904,0.00007807992,0.0001717908,0.00005611651,0.0005400312,0.0007521875,0.835761,0.0128469,0.0001151923,0.0001075641],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9966632,0.001048853,0.00001508316,0.0003180462,0.00002059254,0.00002998822,0.000007309327,0.00000232824,0.001894596],"genre_scores_gemma":[0.999399,0.00010826,0.0000274619,0.00007007918,0.0003392819,1.288839e-7,0.000001562836,0.000001893984,0.00005234412],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.1383523,"threshold_uncertainty_score":0.1589365,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01099308767064374,"score_gpt":0.2313807479189114,"score_spread":0.2203876602482676,"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."}}