{"id":"W2513018011","doi":"10.1107/s2052252516013129","title":"Observation of a re-entrant phase transition in the molecular complex tris(μ<sub>2</sub>-3,5-diisopropyl-1,2,4-triazolato-κ<sup>2</sup><i>N</i><sup>1</sup>:<i>N</i><sup>2</sup>)trigold(I) under high pressure","year":2016,"lang":"en","type":"article","venue":"IUCrJ","topic":"Chemical Thermodynamics and Molecular Structure","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"Lawrence Berkeley National Laboratory; Basic Energy Sciences; Natural Sciences and Engineering Research Council of Canada; Engineering and Physical Sciences Research Council; U.S. Department of Energy; Office of Science; National Science Foundation","keywords":"Chemistry; Tris; Crystallography","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":[0.00004590973,0.0001760109,0.000129345,0.00007689462,0.0002106931,0.0002529795,0.0002981608,0.0001924213,0.00177334],"category_scores_gemma":[0.0001944046,0.0001460147,0.00009024872,0.0001343779,0.0003974953,0.0002081594,0.0002095492,0.0005432752,0.0001163879],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002587662,"about_ca_system_score_gemma":0.0001568878,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006426564,"about_ca_topic_score_gemma":0.0008018849,"domain_scores_codex":[0.9999384,0.000004708961,0.000002472927,0.00001707355,0.00002517355,0.00001214776],"domain_scores_gemma":[0.9998701,0.00003947356,0.00004531496,0.00001183384,0.00001555892,0.00001774529],"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":[0.00008408305,0.00001198,0.0004687455,0.00006125771,0.000005316873,0.00009919308,0.00006621605,0.0001698136,0.9973577,0.0001394261,0.0001200938,0.001416169],"study_design_scores_gemma":[0.00001827659,0.000188009,0.006161101,0.000004450846,0.000008951283,0.000213329,0.0000563304,0.001813459,0.9904187,0.0000698899,0.001036895,0.00001060537],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.99806,0.0001787469,0.0006968621,0.00004206421,0.000008220216,0.00000480455,0.00009648623,0.0000650876,0.0008477006],"genre_scores_gemma":[0.9987029,0.00008741581,0.0006805843,0.00002063551,0.000003344563,0.00001135633,0.0000934657,0.00002475227,0.0003754887],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00177334,"threshold_uncertainty_score":0.005932391,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01542078244339219,"score_gpt":0.240954175266531,"score_spread":0.2255333928231388,"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."}}