{"id":"W2029835761","doi":"10.1021/om000274v","title":"Electronic Structures of Transition Metal Phosphorus Monoxide Complexes","year":2000,"lang":"en","type":"article","venue":"Organometallics","topic":"Chemical Synthesis and Characterization","field":"Environmental Science","cited_by":11,"is_retracted":false,"has_abstract":true,"ca_institutions":"Steacie Institute for Molecular Sciences","funders":"","keywords":"Chemistry; Monoxide; Transition metal; Carbon monoxide; Phosphorus; Density functional theory; Metal; Computational chemistry; Crystallography; Inorganic chemistry; Organic chemistry; Catalysis","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":[0.000216366,0.00044052,0.0007682446,0.0005748837,0.001142331,0.00102433,0.001529923,0.001402392,0.009126694],"category_scores_gemma":[0.0005953256,0.0003733451,0.0003119519,0.0005294727,0.0006387816,0.0005378267,0.0005911511,0.0009117111,0.0005242035],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001157361,"about_ca_system_score_gemma":0.0004885279,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002522758,"about_ca_topic_score_gemma":0.002506184,"domain_scores_codex":[0.9998385,0.00002646477,0.000006116392,0.00002112172,0.00005345841,0.00005434487],"domain_scores_gemma":[0.9998605,0.00005282287,0.00001540756,0.00001927021,0.00003407919,0.00001786493],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001780886,0.000811855,0.009075318,0.002228909,0.000495098,0.001930337,0.0007699989,0.6166072,0.08695111,0.2416585,0.01100208,0.02668877],"study_design_scores_gemma":[0.0008667447,0.0009308546,0.00686505,0.0001236932,0.0001539862,0.0003505062,0.0007533792,0.90909,0.04018237,0.03087489,0.009688874,0.0001196856],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9764313,0.0008187362,0.005184051,0.0004505328,0.00006130475,0.00004444903,0.0004172549,0.0001270601,0.01646535],"genre_scores_gemma":[0.9948362,0.0002821856,0.002003825,0.0001203703,0.000009466749,0.00008428872,0.0006032395,0.00003364032,0.00202674],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.009126694,"threshold_uncertainty_score":0.03053182,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004707506502084105,"score_gpt":0.1839131695077432,"score_spread":0.1792056630056591,"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."}}