{"record_type":"pith_number_record","schema_url":"https://pith.science/schemas/pith-number/v1.json","pith_number":"pith:2022:ZNLS7WDDNNSQDYVKDDOBZMBCNY","short_pith_number":"pith:ZNLS7WDD","schema_version":"1.0","canonical_sha256":"cb572fd8636b6501e2aa18dc1cb0226e250b4c7dcd78c37198b29102d5a8c3b2","source":{"kind":"arxiv","id":"2203.15732","version":2},"attestation_state":"computed","paper":{"title":"Accurate electronic properties and intercalation voltages of olivine-type Li-ion cathode materials from extended Hubbard functionals","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Francesco Aquilante, Iurii Timrov, Matteo Cococcioni, Nicola Marzari","submitted_at":"2022-03-29T16:42:09Z","abstract_excerpt":"The design of novel cathode materials for Li-ion batteries would greatly benefit from accurate first-principles predictions of structural, electronic, and magnetic properties as well as intercalation voltages in compounds containing transition-metal elements. For such systems, density-functional theory (DFT) with standard (semi-)local exchange-correlation functionals is of limited use as it often fails due to strong self-interaction errors that are especially relevant in the partially filled $d$ shells. Here, we perform a detailed comparative study of the phospho-olivine cathode materials Li$_"},"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":"2203.15732","kind":"arxiv","version":2},"metadata":{"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"cond-mat.mtrl-sci","submitted_at":"2022-03-29T16:42:09Z","cross_cats_sorted":[],"title_canon_sha256":"bb4a97f8745725a1417c205230df75cccf7154ea244be75d8bdddf1a3a6e1416","abstract_canon_sha256":"210337c3620ddf8fed075342080e92d0e7c72925823188fceb2358397c0c9da1"},"schema_version":"1.0"},"receipt":{"kind":"pith_receipt","key_id":"pith-v1-2026-05","algorithm":"ed25519","signed_at":"2026-07-05T05:12:44.206689Z","signature_b64":"x0uZjNbGpCv2upaNUfQ2n/5TZiLzy8dci2j5spWHtYQ9vWItw0dBD5+U69xdKUQJgt3QZUcEMogewpZfgz4RAw==","signed_message":"canonical_sha256_bytes","builder_version":"pith-number-builder-2026-05-17-v1","receipt_version":"0.3","canonical_sha256":"cb572fd8636b6501e2aa18dc1cb0226e250b4c7dcd78c37198b29102d5a8c3b2","last_reissued_at":"2026-07-05T05:12:44.206136Z","signature_status":"signed_v1","first_computed_at":"2026-07-05T05:12:44.206136Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54"},"graph_snapshot":{"paper":{"title":"Accurate electronic properties and intercalation voltages of olivine-type Li-ion cathode materials from extended Hubbard functionals","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Francesco Aquilante, Iurii Timrov, Matteo Cococcioni, Nicola Marzari","submitted_at":"2022-03-29T16:42:09Z","abstract_excerpt":"The design of novel cathode materials for Li-ion batteries would greatly benefit from accurate first-principles predictions of structural, electronic, and magnetic properties as well as intercalation voltages in compounds containing transition-metal elements. For such systems, density-functional theory (DFT) with standard (semi-)local exchange-correlation functionals is of limited use as it often fails due to strong self-interaction errors that are especially relevant in the partially filled $d$ shells. Here, we perform a detailed comparative study of the phospho-olivine cathode materials Li$_"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"2203.15732","kind":"arxiv","version":2},"verdict":{"id":null,"model_set":{},"created_at":null,"strongest_claim":"","one_line_summary":"","pipeline_version":null,"weakest_assumption":"","pith_extraction_headline":""},"integrity":{"clean":true,"summary":{"advisory":0,"critical":0,"by_detector":{},"informational":0},"endpoint":"/pith/2203.15732/integrity.json","findings":[],"available":true,"detectors_run":[],"snapshot_sha256":"c28c3603d3b5d939e8dc4c7e95fa8dfce3d595e45f758748cecf8e644a296938"},"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":"2203.15732","created_at":"2026-07-05T05:12:44.206194+00:00"},{"alias_kind":"arxiv_version","alias_value":"2203.15732v2","created_at":"2026-07-05T05:12:44.206194+00:00"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.2203.15732","created_at":"2026-07-05T05:12:44.206194+00:00"},{"alias_kind":"pith_short_12","alias_value":"ZNLS7WDDNNSQ","created_at":"2026-07-05T05:12:44.206194+00:00"},{"alias_kind":"pith_short_16","alias_value":"ZNLS7WDDNNSQDYVK","created_at":"2026-07-05T05:12:44.206194+00:00"},{"alias_kind":"pith_short_8","alias_value":"ZNLS7WDD","created_at":"2026-07-05T05:12:44.206194+00:00"}],"events":[],"event_summary":{},"paper_claims":[],"inbound_citations":{"count":1,"internal_anchor_count":1,"sample":[{"citing_arxiv_id":"2412.16816","citing_title":"The Interplay Between Electron Localization, Magnetic Order, and Jahn-Teller Distortion that Dictates LiMnO$_2$ Phase Stability","ref_index":38,"is_internal_anchor":true}]},"formal_canon":{"evidence_count":0,"sample":[],"anchors":[]},"links":{"html":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY","json":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY.json","graph_json":"https://pith.science/api/pith-number/ZNLS7WDDNNSQDYVKDDOBZMBCNY/graph.json","events_json":"https://pith.science/api/pith-number/ZNLS7WDDNNSQDYVKDDOBZMBCNY/events.json","paper":"https://pith.science/paper/ZNLS7WDD"},"agent_actions":{"view_html":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY","download_json":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY.json","view_paper":"https://pith.science/paper/ZNLS7WDD","resolve_alias":"https://pith.science/api/pith-number/resolve?arxiv=2203.15732&json=true","fetch_graph":"https://pith.science/api/pith-number/ZNLS7WDDNNSQDYVKDDOBZMBCNY/graph.json","fetch_events":"https://pith.science/api/pith-number/ZNLS7WDDNNSQDYVKDDOBZMBCNY/events.json","actions":{"anchor_timestamp":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY/action/timestamp_anchor","attest_storage":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY/action/storage_attestation","attest_author":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY/action/author_attestation","sign_citation":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY/action/citation_signature","submit_replication":"https://pith.science/pith/ZNLS7WDDNNSQDYVKDDOBZMBCNY/action/replication_record"}},"created_at":"2026-07-05T05:12:44.206194+00:00","updated_at":"2026-07-05T05:12:44.206194+00:00"}