{"record_type":"pith_number_record","schema_url":"https://pith.science/schemas/pith-number/v1.json","pith_number":"pith:2014:7HIBT6IEF2TNBEM3WBS2VHO3QT","short_pith_number":"pith:7HIBT6IE","schema_version":"1.0","canonical_sha256":"f9d019f9042ea6d0919bb065aa9ddb84d6c3d5e4f525ee07644dd724373c0640","source":{"kind":"arxiv","id":"1403.5525","version":3},"attestation_state":"computed","paper":{"title":"Tuning the Electronic Structure of Anatase Through Fluorination","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Damien Dambournet, Dario Corradini, Mathieu Salanne","submitted_at":"2014-03-21T17:43:27Z","abstract_excerpt":"A highly fluorinated anatase lattice has been recently reported, providing a new class of materials whose general chemical formula is $\\rm Ti_{1- \\mathit x}\\square_{\\mathit x}X_{4\\mathit x}O_{2- 4\\mathit x}$ (X$^-$ = F$^-$ or OH$^-$). To characterise the complex structural features of the material and the different F environments, we here apply a computational screening procedure. After deriving a polarisable force--field from DFT simulations, we screen in a step-wise fashion a large number of possible configurations differing in the positioning of the titanium vacancies ($\\square$) and of the"},"verification_status":{"content_addressed":true,"pith_receipt":true,"author_attested":false,"weak_author_claims":0,"strong_author_claims":0,"externally_anchored":false,"storage_verified":false,"citation_signatures":0,"replication_records":0,"graph_snapshot":true,"references_resolved":false,"formal_links_present":false},"canonical_record":{"source":{"id":"1403.5525","kind":"arxiv","version":3},"metadata":{"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"cond-mat.mtrl-sci","submitted_at":"2014-03-21T17:43:27Z","cross_cats_sorted":[],"title_canon_sha256":"0228cbce9e8503db8d7594721e41867790b93d15cad06753ad83edb1c3b347ec","abstract_canon_sha256":"acd0c88313135d80ef433bf5ae9e901bf4795b7bd5a1678f89035092f30abf4d"},"schema_version":"1.0"},"receipt":{"kind":"pith_receipt","key_id":"pith-v1-2026-05","algorithm":"ed25519","signed_at":"2026-05-18T01:37:51.283544Z","signature_b64":"jcHfr4NQEzoBZ927KFYbtEQTH7A+OfgARnv3UNs0coTRZlUva5p4i4atEx0k0YtqrWLLBbFGaQMbXL27Pc0EBQ==","signed_message":"canonical_sha256_bytes","builder_version":"pith-number-builder-2026-05-17-v1","receipt_version":"0.3","canonical_sha256":"f9d019f9042ea6d0919bb065aa9ddb84d6c3d5e4f525ee07644dd724373c0640","last_reissued_at":"2026-05-18T01:37:51.282778Z","signature_status":"signed_v1","first_computed_at":"2026-05-18T01:37:51.282778Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54"},"graph_snapshot":{"paper":{"title":"Tuning the Electronic Structure of Anatase Through Fluorination","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Damien Dambournet, Dario Corradini, Mathieu Salanne","submitted_at":"2014-03-21T17:43:27Z","abstract_excerpt":"A highly fluorinated anatase lattice has been recently reported, providing a new class of materials whose general chemical formula is $\\rm Ti_{1- \\mathit x}\\square_{\\mathit x}X_{4\\mathit x}O_{2- 4\\mathit x}$ (X$^-$ = F$^-$ or OH$^-$). To characterise the complex structural features of the material and the different F environments, we here apply a computational screening procedure. After deriving a polarisable force--field from DFT simulations, we screen in a step-wise fashion a large number of possible configurations differing in the positioning of the titanium vacancies ($\\square$) and of the"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"1403.5525","kind":"arxiv","version":3},"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"},"aliases":[{"alias_kind":"arxiv","alias_value":"1403.5525","created_at":"2026-05-18T01:37:51.282904+00:00"},{"alias_kind":"arxiv_version","alias_value":"1403.5525v3","created_at":"2026-05-18T01:37:51.282904+00:00"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.1403.5525","created_at":"2026-05-18T01:37:51.282904+00:00"},{"alias_kind":"pith_short_12","alias_value":"7HIBT6IEF2TN","created_at":"2026-05-18T12:28:16.859392+00:00"},{"alias_kind":"pith_short_16","alias_value":"7HIBT6IEF2TNBEM3","created_at":"2026-05-18T12:28:16.859392+00:00"},{"alias_kind":"pith_short_8","alias_value":"7HIBT6IE","created_at":"2026-05-18T12:28:16.859392+00:00"}],"events":[],"event_summary":{},"paper_claims":[],"inbound_citations":{"count":0,"internal_anchor_count":0,"sample":[]},"formal_canon":{"evidence_count":0,"sample":[],"anchors":[]},"links":{"html":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT","json":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT.json","graph_json":"https://pith.science/api/pith-number/7HIBT6IEF2TNBEM3WBS2VHO3QT/graph.json","events_json":"https://pith.science/api/pith-number/7HIBT6IEF2TNBEM3WBS2VHO3QT/events.json","paper":"https://pith.science/paper/7HIBT6IE"},"agent_actions":{"view_html":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT","download_json":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT.json","view_paper":"https://pith.science/paper/7HIBT6IE","resolve_alias":"https://pith.science/api/pith-number/resolve?arxiv=1403.5525&json=true","fetch_graph":"https://pith.science/api/pith-number/7HIBT6IEF2TNBEM3WBS2VHO3QT/graph.json","fetch_events":"https://pith.science/api/pith-number/7HIBT6IEF2TNBEM3WBS2VHO3QT/events.json","actions":{"anchor_timestamp":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT/action/timestamp_anchor","attest_storage":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT/action/storage_attestation","attest_author":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT/action/author_attestation","sign_citation":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT/action/citation_signature","submit_replication":"https://pith.science/pith/7HIBT6IEF2TNBEM3WBS2VHO3QT/action/replication_record"}},"created_at":"2026-05-18T01:37:51.282904+00:00","updated_at":"2026-05-18T01:37:51.282904+00:00"}