{"record_type":"pith_number_record","schema_url":"https://pith.science/schemas/pith-number/v1.json","pith_number":"pith:2024:NZ5AMM7DPR5ZXDADQGIIYQCKKR","short_pith_number":"pith:NZ5AMM7D","schema_version":"1.0","canonical_sha256":"6e7a0633e37c7b9b8c0381908c404a544f3857a7dd52ee98edf13969d3f1f501","source":{"kind":"arxiv","id":"2406.04966","version":2},"attestation_state":"computed","paper":{"title":"Crystal Structure Prediction and Phase Stability in Highly Anharmonic Silver-Based Chalcohalide Anti-Perovskites","license":"http://creativecommons.org/licenses/by/4.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Cibr\\'an L\\'opez, Claudio Cazorla, Cong Liu, Edgardo Saucedo, Ivan Ca\\~no, Josep Llu\\'is Tamarit, Pol Ben\\'itez","submitted_at":"2024-06-07T14:31:02Z","abstract_excerpt":"Silver-based chalcohalide anti-perovskites (CAP), Ag$_{3}$BC (B = S, Se; C = Cl, Br, I), represent an emerging family of energy materials with intriguing optoelectronic, vibrational and ionic transport properties. However, the structural features and phase stability of CAP remain poorly investigated to date, hindering their fundamental understanding and potential integration into technological applications. Here we employ theoretical first-principles methods based on density functional theory to fill this knowledge gap. Through crystal structure prediction techniques, ab initio molecular dynam"},"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":"2406.04966","kind":"arxiv","version":2},"metadata":{"license":"http://creativecommons.org/licenses/by/4.0/","primary_cat":"cond-mat.mtrl-sci","submitted_at":"2024-06-07T14:31:02Z","cross_cats_sorted":[],"title_canon_sha256":"f1071fa8e1cb53c0f1dd58288486396fd4514aaca984e4426bf774839e3089d5","abstract_canon_sha256":"5a393f195ca129c65b5164078fa970093c6ac05a93a749fa557095f58fe98348"},"schema_version":"1.0"},"receipt":{"kind":"pith_receipt","key_id":"pith-v1-2026-05","algorithm":"ed25519","signed_at":"2026-07-05T09:27:01.940487Z","signature_b64":"zBLLvnCS2SmKG4JYi1rqCb1sF8p8HYldbbjpWzIGmXqpuTBPLzRLqeUA//c7QT9F+FeyI9e1xY/G0AiOX8heAg==","signed_message":"canonical_sha256_bytes","builder_version":"pith-number-builder-2026-05-17-v1","receipt_version":"0.3","canonical_sha256":"6e7a0633e37c7b9b8c0381908c404a544f3857a7dd52ee98edf13969d3f1f501","last_reissued_at":"2026-07-05T09:27:01.939946Z","signature_status":"signed_v1","first_computed_at":"2026-07-05T09:27:01.939946Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54"},"graph_snapshot":{"paper":{"title":"Crystal Structure Prediction and Phase Stability in Highly Anharmonic Silver-Based Chalcohalide Anti-Perovskites","license":"http://creativecommons.org/licenses/by/4.0/","headline":"","cross_cats":[],"primary_cat":"cond-mat.mtrl-sci","authors_text":"Cibr\\'an L\\'opez, Claudio Cazorla, Cong Liu, Edgardo Saucedo, Ivan Ca\\~no, Josep Llu\\'is Tamarit, Pol Ben\\'itez","submitted_at":"2024-06-07T14:31:02Z","abstract_excerpt":"Silver-based chalcohalide anti-perovskites (CAP), Ag$_{3}$BC (B = S, Se; C = Cl, Br, I), represent an emerging family of energy materials with intriguing optoelectronic, vibrational and ionic transport properties. However, the structural features and phase stability of CAP remain poorly investigated to date, hindering their fundamental understanding and potential integration into technological applications. Here we employ theoretical first-principles methods based on density functional theory to fill this knowledge gap. Through crystal structure prediction techniques, ab initio molecular dynam"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"2406.04966","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/2406.04966/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":"2406.04966","created_at":"2026-07-05T09:27:01.940014+00:00"},{"alias_kind":"arxiv_version","alias_value":"2406.04966v2","created_at":"2026-07-05T09:27:01.940014+00:00"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.2406.04966","created_at":"2026-07-05T09:27:01.940014+00:00"},{"alias_kind":"pith_short_12","alias_value":"NZ5AMM7DPR5Z","created_at":"2026-07-05T09:27:01.940014+00:00"},{"alias_kind":"pith_short_16","alias_value":"NZ5AMM7DPR5ZXDAD","created_at":"2026-07-05T09:27:01.940014+00:00"},{"alias_kind":"pith_short_8","alias_value":"NZ5AMM7D","created_at":"2026-07-05T09:27:01.940014+00:00"}],"events":[],"event_summary":{},"paper_claims":[],"inbound_citations":{"count":1,"internal_anchor_count":1,"sample":[{"citing_arxiv_id":"2411.16279","citing_title":"Giant Electron-Phonon Coupling Induced Band-Gap Renormalization in Anharmonic Silver Chalcohalide Antiperovskites","ref_index":17,"is_internal_anchor":true}]},"formal_canon":{"evidence_count":0,"sample":[],"anchors":[]},"links":{"html":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR","json":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR.json","graph_json":"https://pith.science/api/pith-number/NZ5AMM7DPR5ZXDADQGIIYQCKKR/graph.json","events_json":"https://pith.science/api/pith-number/NZ5AMM7DPR5ZXDADQGIIYQCKKR/events.json","paper":"https://pith.science/paper/NZ5AMM7D"},"agent_actions":{"view_html":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR","download_json":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR.json","view_paper":"https://pith.science/paper/NZ5AMM7D","resolve_alias":"https://pith.science/api/pith-number/resolve?arxiv=2406.04966&json=true","fetch_graph":"https://pith.science/api/pith-number/NZ5AMM7DPR5ZXDADQGIIYQCKKR/graph.json","fetch_events":"https://pith.science/api/pith-number/NZ5AMM7DPR5ZXDADQGIIYQCKKR/events.json","actions":{"anchor_timestamp":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR/action/timestamp_anchor","attest_storage":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR/action/storage_attestation","attest_author":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR/action/author_attestation","sign_citation":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR/action/citation_signature","submit_replication":"https://pith.science/pith/NZ5AMM7DPR5ZXDADQGIIYQCKKR/action/replication_record"}},"created_at":"2026-07-05T09:27:01.940014+00:00","updated_at":"2026-07-05T09:27:01.940014+00:00"}