{"id":"W1988192172","doi":"10.1107/s0909049512040617","title":"Electronic structure and hybridization of CaS by means of X-ray absorption spectroscopy at Ca and S <i>K</i>-edges","year":2012,"lang":"en","type":"article","venue":"Journal of Synchrotron Radiation","topic":"X-ray Spectroscopy and Fluorescence Analysis","field":"Physics and Astronomy","cited_by":7,"is_retracted":false,"has_abstract":true,"ca_institutions":"Canadian Light Source (Canada); University of Saskatchewan","funders":"National Natural Science Foundation of China","keywords":"Electronic structure; Absorption spectroscopy; Tin; Scattering; Absorption (acoustics); Spectroscopy; Density of states; Density functional theory; Electronic band structure; Atomic physics; Absorption edge; Chemistry; Physics; Materials science; Condensed matter physics; Optics; Band gap; Quantum mechanics; Computational chemistry","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":[0.0001202311,0.0002122801,0.0002134219,0.0003952256,0.0004271666,0.0003806417,0.0004645944,0.0003016657,0.001554438],"category_scores_gemma":[0.0002489663,0.0001579821,0.000160503,0.0004617379,0.0004636335,0.0003231153,0.0003178141,0.0003050402,0.00009703025],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006098819,"about_ca_system_score_gemma":0.0002993128,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.002568572,"about_ca_topic_score_gemma":0.002921299,"domain_scores_codex":[0.9999117,0.00001079261,0.000004220884,0.00001884504,0.00003930697,0.00001513371],"domain_scores_gemma":[0.9999369,0.00002341748,0.00001302748,0.000008176457,0.0000135695,0.000004825748],"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":[0.0008668908,0.0001449737,0.01595112,0.001006485,0.00008449132,0.0008165932,0.001094471,0.08197588,0.824706,0.05130798,0.001511944,0.02053313],"study_design_scores_gemma":[0.0001154914,0.0005039858,0.03949605,0.00008490498,0.00008605521,0.0004962913,0.001065577,0.5459976,0.396868,0.01004199,0.005145192,0.00009896443],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9944343,0.0002080099,0.00160209,0.00008278752,0.000006357908,0.000005252145,0.00006621113,0.00004158949,0.003553418],"genre_scores_gemma":[0.997655,0.00009687038,0.001703596,0.00001100931,0.000001460635,0.000006698815,0.00007802393,0.000006017116,0.0004413179],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002568572,"threshold_uncertainty_score":0.005200088,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.003036263882906929,"score_gpt":0.2228037779456956,"score_spread":0.2197675140627887,"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."}}