{"paper":{"title":"Extended Czjzek model applied to NMR parameter distributions in sodium metaphosphate glass","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.dis-nn","authors_text":"Filipe Vasconcelos, Francesco Mauri, G\\'erard Le Ca\\\"er, Jean-Fran\\c{c}ois Paul, Laurent Delevoye, Sylvain Cristol, Thibault Charpentier","submitted_at":"2013-05-21T12:28:37Z","abstract_excerpt":"The Extended Czjzek Model (ECM) is applied to the distribution of NMR parameters of a simple glass model (sodium metaphosphate, $\\mathrm{NaPO_3}$) obtained by Molecular Dynamics (MD) simulations. Accurate NMR tensors, Electric Field Gradient (EFG) and Chemical Shift Anisotropy (CSA), are calculated from Density Functional Theory (DFT) within the well-established PAW/GIPAW framework. Theoretical results are compared to experimental high-resolution solid-state NMR data and are used to validate the considered structural model. The distributions of the calculated coupling constant $C_Q\\propto |V_{"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"1305.4796","kind":"arxiv","version":1},"verdict":{"id":null,"model_set":{},"created_at":null,"strongest_claim":"","one_line_summary":"","pipeline_version":null,"weakest_assumption":"","pith_extraction_headline":""},"references":{"count":0,"sample":[],"resolved_work":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57","internal_anchors":0},"formal_canon":{"evidence_count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"author_claims":{"count":0,"strong_count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"builder_version":"pith-number-builder-2026-05-17-v1"}