{"id":"W2315377763","doi":"10.1021/jp507291m","title":"Structural Tuning of Energetic Material Bis(1<i>H</i>-tetrazol-5-yl)amine Monohydrate under Pressures Probed by Vibrational Spectroscopy and X-ray Diffraction","year":2014,"lang":"en","type":"article","venue":"The Journal of Physical Chemistry C","topic":"Energetic Materials and Combustion","field":"Engineering","cited_by":5,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa; Defence Research and Development Canada; Western University","funders":"Natural Sciences and Engineering Research Council of Canada; Defence Research and Development Canada; Canada Foundation for Innovation","keywords":"Raman spectroscopy; Hydrogen bond; Crystallography; Infrared spectroscopy; Chemistry; Diffraction; Infrared; Materials science; Analytical Chemistry (journal); Molecule; Organic chemistry; Optics","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":[0.00009560371,0.000249813,0.000135551,0.0001766585,0.000128672,0.0002459532,0.0002256789,0.00025261,0.0009305802],"category_scores_gemma":[0.0001214256,0.0002062657,0.00008465703,0.0001198318,0.0001966458,0.0002488419,0.0001762371,0.0002744494,0.0001665363],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001969242,"about_ca_system_score_gemma":0.00008813114,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000214451,"about_ca_topic_score_gemma":0.0005533667,"domain_scores_codex":[0.9999167,0.000006819771,0.000004764265,0.00001517422,0.00004001697,0.00001653026],"domain_scores_gemma":[0.9999455,0.00001050252,0.00001807081,0.000004392012,0.00001149422,0.00001006679],"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":[0.00002386649,0.000006697848,0.00009866794,0.00002716753,0.000001551866,0.00001881276,0.000008604718,0.0001826545,0.9991732,0.00006223159,0.00002064775,0.0003758685],"study_design_scores_gemma":[0.000009255608,0.0001376162,0.002699427,0.000004037438,0.000004470989,0.0000544707,0.00002825984,0.003400374,0.9927809,0.00003155816,0.0008435698,0.00000608468],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9976429,0.0002917162,0.0009046661,0.00003610116,0.000009743469,0.00000942828,0.0001368293,0.00005068818,0.0009178738],"genre_scores_gemma":[0.9978997,0.000223285,0.00117708,0.00001208408,0.000004669598,0.00001785481,0.0001212136,0.00001969014,0.0005245431],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0009305802,"threshold_uncertainty_score":0.003113091,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.003300303342177922,"score_gpt":0.1880447154561735,"score_spread":0.1847444121139956,"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."}}