{"id":"W2006876142","doi":"10.1103/physrevb.84.075438","title":"Surface stress changes in the Ir(001)/H system: Density functional theory study","year":2011,"lang":"en","type":"article","venue":"Physical Review B","topic":"Advanced Chemical Physics Studies","field":"Physics and Astronomy","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Engineering and Physical Sciences Research Council; Research Nova Scotia; University of Warwick","keywords":"Surface stress; Surface reconstruction; Density functional theory; Materials science; Surface (topology); Hydrogen; Ultimate tensile strength; Stress (linguistics); Surface energy; Adsorption; Range (aeronautics); Energy (signal processing); Atomic physics; Physics; Physical chemistry; Composite material; Geometry; Quantum mechanics; Chemistry; Mathematics","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000726267,0.0006418606,0.001033609,0.0005957031,0.0009143213,0.0008807959,0.001298458,0.001298786,0.003641901],"category_scores_gemma":[0.000566668,0.0003433327,0.0007720021,0.0006646227,0.0008460435,0.000497336,0.0005619716,0.0009568325,0.0003817071],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000899866,"about_ca_system_score_gemma":0.0008318187,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.007202805,"about_ca_topic_score_gemma":0.005128449,"domain_scores_codex":[0.9997516,0.00004998364,0.000005691239,0.00002052005,0.00009227038,0.00007985687],"domain_scores_gemma":[0.9997357,0.0001200284,0.00002279027,0.00003036896,0.00006409067,0.00002708929],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.001038181,0.0008121391,0.007876757,0.002288979,0.0004150919,0.002255169,0.0009467611,0.7649042,0.10103,0.08380317,0.007559945,0.02706951],"study_design_scores_gemma":[0.00007937507,0.0001846494,0.002702978,0.00005076015,0.00003201476,0.00007306784,0.0002072975,0.9872269,0.005312765,0.003541727,0.0005427583,0.00004571292],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9794747,0.0008658117,0.008059546,0.0005386706,0.00005319219,0.00006397311,0.0003935476,0.0002036558,0.0103468],"genre_scores_gemma":[0.9932919,0.0006035645,0.003658691,0.0001449418,0.00002777769,0.0001156707,0.0006009943,0.00004528664,0.001511149],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007202805,"threshold_uncertainty_score":0.01432174,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04373572059127217,"score_gpt":0.2937749784439349,"score_spread":0.2500392578526627,"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."}}