{"id":"W2005862482","doi":"10.1039/c4cc00987h","title":"Desorption of hydrogen from light metal hydrides: concerted electronic rearrangement and role of H⋯H interactions","year":2014,"lang":"en","type":"article","venue":"Chemical Communications","topic":"Hydrogen Storage and Materials","field":"Materials Science","cited_by":8,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Fredericton; University of New Brunswick","funders":"","keywords":"Metal; Hydrogen; Desorption; Photochemistry; Chemistry; Hydride; Inorganic chemistry; Computational chemistry; Physical chemistry; Organic chemistry; Adsorption","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":[],"consensus_categories":[],"category_scores_codex":[0.0002404658,0.00008701721,0.0002333325,0.00003650031,0.00005986632,0.00001256718,0.0004205779,0.00005037445,0.0001698525],"category_scores_gemma":[0.0001016086,0.00008210818,0.00004920318,0.0000818938,0.0001756041,0.0001115816,0.0002392075,0.00007988898,0.00002183865],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003317193,"about_ca_system_score_gemma":0.00002407179,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003107962,"about_ca_topic_score_gemma":0.00004832943,"domain_scores_codex":[0.999129,0.0001410648,0.0003474184,0.0001457333,0.000102999,0.0001337592],"domain_scores_gemma":[0.9986921,0.0001876806,0.0001908726,0.0008010525,0.00007645052,0.00005182511],"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":[0.00001456209,0.00007872039,0.00003245551,0.000007717339,0.00002433511,2.311325e-8,0.0003618278,0.000001593463,0.9967877,0.002146724,0.00002542904,0.0005189163],"study_design_scores_gemma":[0.0001889086,0.00002581736,0.00001679986,0.00002719126,0.0000692191,0.000001684968,0.00008941983,0.0004788224,0.9845174,0.004271755,0.01023866,0.00007432357],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9975932,0.0008718062,0.0001761746,0.000211186,0.00002583725,0.0001192369,0.00004502591,0.00003164542,0.0009259073],"genre_scores_gemma":[0.9981318,0.0001290329,0.00153844,0.00002626638,0.00002433284,0.00003901496,0.00008510385,0.000009588772,0.00001649104],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0122703,"threshold_uncertainty_score":0.3348275,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01516985059784254,"score_gpt":0.2594560076385341,"score_spread":0.2442861570406916,"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."}}