{"id":"W3037134643","doi":"10.1021/acs.chemrev.9b00813","title":"Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular Interaction","year":2020,"lang":"en","type":"review","venue":"Chemical Reviews","topic":"Spectroscopy and Quantum Chemical Studies","field":"Physics and Astronomy","cited_by":403,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"H2020 Marie Skłodowska-Curie Actions; Division of Molecular and Cellular Biosciences; Institute for Basic Science; U.S. Department of Energy; European Commission; Seoul National University; National Institutes of Health; Rijksuniversiteit Groningen; University of Nottingham; National Institute of General Medical Sciences; Narodowym Centrum Nauki; Narodowe Centrum Nauki; Carnegie Mellon University; University of Rochester; Welch Foundation; Division of Chemistry; University of Oxford; National Science Foundation","keywords":"Chemistry; Intermolecular force; Spectroscopy; Infrared spectroscopy; Chemical physics; Computational chemistry; Molecular vibration; Molecular physics; Physical chemistry; Molecule; Organic chemistry; 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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001140985,0.0007193086,0.002284011,0.00005621688,0.0001118524,0.0001401346,0.0003170324,0.0001629672,0.001945869],"category_scores_gemma":[0.00007093301,0.0005652962,0.000751761,0.0002376646,0.000150717,0.0001521698,0.0002878431,0.0008850083,0.0006267853],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001477155,"about_ca_system_score_gemma":0.0001135109,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000005210868,"about_ca_topic_score_gemma":1.980776e-7,"domain_scores_codex":[0.9973952,0.00009613416,0.001048052,0.0008386808,0.0002340697,0.0003878615],"domain_scores_gemma":[0.9987326,0.0001887624,0.0005160149,0.0002950903,0.00002968643,0.0002378164],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00003166244,0.0002899616,0.00003028788,0.01497642,0.0008822276,0.00001524319,0.00009266979,4.156999e-8,0.03410225,0.03520641,0.03419383,0.880179],"study_design_scores_gemma":[0.0001301022,0.00003559393,3.534422e-7,0.003946957,0.0004526971,0.000006960126,0.000006938211,0.00001179142,0.01547788,0.002408807,0.9770404,0.0004814984],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.000007987991,0.9856811,0.009515945,0.0002511228,0.0002629723,0.0008079875,0.00007308236,0.00004718286,0.003352616],"genre_scores_gemma":[0.00002013607,0.990877,0.005846647,0.0001381084,0.001815687,0.0003481276,0.0008608763,0.0000590047,0.00003439438],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.9428466,"threshold_uncertainty_score":0.9996799,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03706378790309405,"score_gpt":0.344875563411613,"score_spread":0.307811775508519,"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."}}