{"id":"W3111072656","doi":"10.1002/mrc.5122","title":"<sup>17</sup>O solid‐state NMR at ultrahigh magnetic field of 35.2 T: Resolution of inequivalent oxygen sites in different phases of MOF MIL‐53(Al)","year":2021,"lang":"en","type":"article","venue":"Magnetic Resonance in Chemistry","topic":"Advanced NMR Techniques and Applications","field":"Chemistry","cited_by":26,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"National Institute of General Medical Sciences; National Natural Science Foundation of China","keywords":"Chemistry; Solid-state nuclear magnetic resonance; Oxygen-17; Crystallography; Magic angle spinning; Metal-organic framework; Crystal structure; NMR spectra database; Nuclear magnetic resonance spectroscopy; Phase (matter); Oxygen; Spectral line; Nuclear magnetic resonance; Adsorption; Physical chemistry; Stereochemistry","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":[0.0001362277,0.0002059575,0.00007805258,0.0001490058,0.0001494102,0.000208811,0.0001959762,0.000277528,0.0007521169],"category_scores_gemma":[0.0001303992,0.0001027039,0.00006698018,0.0001027683,0.0003058518,0.0002147569,0.0001542296,0.0003105039,0.0001411285],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001274923,"about_ca_system_score_gemma":0.00007439069,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006240687,"about_ca_topic_score_gemma":0.001095016,"domain_scores_codex":[0.9999294,0.000008085215,0.000003731621,0.00001639957,0.00002576958,0.00001669447],"domain_scores_gemma":[0.9999107,0.00002299915,0.00003265367,0.000007391425,0.00001608824,0.00001019221],"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":[0.00008011968,0.00000442539,0.0005308337,0.00003008439,0.000003282708,0.00007498504,0.00003744627,0.0001017262,0.9975356,0.0001461785,0.0001402718,0.001315076],"study_design_scores_gemma":[0.00001032919,0.00007480609,0.008024796,0.000005663521,0.00001072529,0.0003204299,0.0001057213,0.001853372,0.986921,0.0001246066,0.002540099,0.000008443717],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9949613,0.0004539402,0.002550057,0.0001405721,0.00002026168,0.000003923201,0.0001901509,0.0000789203,0.001600911],"genre_scores_gemma":[0.9955746,0.0001620727,0.003284443,0.00007862921,0.00001039911,0.000005555299,0.0002869581,0.00001688964,0.0005804746],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0007521169,"threshold_uncertainty_score":0.002516091,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01355081466709816,"score_gpt":0.279417868015545,"score_spread":0.2658670533484468,"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."}}