{"record_type":"pith_number_record","schema_url":"https://pith.science/schemas/pith-number/v1.json","pith_number":"pith:2013:37KKODIUQADRU34ZYVFBE3ZNJC","short_pith_number":"pith:37KKODIU","schema_version":"1.0","canonical_sha256":"dfd4a70d1480071a6f99c54a126f2d48b0e0bf9c077cf70ba32d6fba06340954","source":{"kind":"arxiv","id":"1311.7022","version":2},"attestation_state":"computed","paper":{"title":"DFT-D Investigation of the Interaction Between Ir(III) Based Photosensitizers and Small Silver Clusters Ag$_n$ ($n$=2-20, 92)","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":["physics.chem-ph"],"primary_cat":"physics.atm-clus","authors_text":"Olga S. Bokareva, Oliver K\\\"uhn","submitted_at":"2013-11-27T16:02:52Z","abstract_excerpt":"A dispersion-corrected density functional theory study of the photosensitizer [Ir(ppy)$_2$(bpy)]$^+$ and its derivatives bound to silver clusters Ag$_n$ ($n$=2-20, 92) is performed. The goal is to provide a new system-specific set of $C_{\\rm 6}^{}$ interaction parameters for Ag and Ir atoms. To this end a QM:QM scheme is employed using the PBE functional and RPA as well as MP2 calculation as a reference. The obtained $C_{\\rm 6}^{}$ coefficients were applied to calculate dissociation curves of selected IrPS-Ag$_n$ complexes and binding energies of derivatives containing oxygen and sulphur as he"},"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":"1311.7022","kind":"arxiv","version":2},"metadata":{"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"physics.atm-clus","submitted_at":"2013-11-27T16:02:52Z","cross_cats_sorted":["physics.chem-ph"],"title_canon_sha256":"640f0d492a990f3eeb67c6613ace6bd54dd731c6c9cf758e7a40553b3d9e43e6","abstract_canon_sha256":"d0e68d644c99ee42c4fba45c0b2eabf352d61f3096e31b79ffe9eb3e05fa6c80"},"schema_version":"1.0"},"receipt":{"kind":"pith_receipt","key_id":"pith-v1-2026-05","algorithm":"ed25519","signed_at":"2026-05-18T01:46:05.559521Z","signature_b64":"x4XGq3f2PtKIerWJHan0S7E0RlFOcFsj4hoEaE8H65ZnJNc64l7LMwZ2Dj7U8zklOMbJ8JtZCE90OiRpJ2qmBw==","signed_message":"canonical_sha256_bytes","builder_version":"pith-number-builder-2026-05-17-v1","receipt_version":"0.3","canonical_sha256":"dfd4a70d1480071a6f99c54a126f2d48b0e0bf9c077cf70ba32d6fba06340954","last_reissued_at":"2026-05-18T01:46:05.559000Z","signature_status":"signed_v1","first_computed_at":"2026-05-18T01:46:05.559000Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54"},"graph_snapshot":{"paper":{"title":"DFT-D Investigation of the Interaction Between Ir(III) Based Photosensitizers and Small Silver Clusters Ag$_n$ ($n$=2-20, 92)","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":["physics.chem-ph"],"primary_cat":"physics.atm-clus","authors_text":"Olga S. Bokareva, Oliver K\\\"uhn","submitted_at":"2013-11-27T16:02:52Z","abstract_excerpt":"A dispersion-corrected density functional theory study of the photosensitizer [Ir(ppy)$_2$(bpy)]$^+$ and its derivatives bound to silver clusters Ag$_n$ ($n$=2-20, 92) is performed. The goal is to provide a new system-specific set of $C_{\\rm 6}^{}$ interaction parameters for Ag and Ir atoms. To this end a QM:QM scheme is employed using the PBE functional and RPA as well as MP2 calculation as a reference. The obtained $C_{\\rm 6}^{}$ coefficients were applied to calculate dissociation curves of selected IrPS-Ag$_n$ complexes and binding energies of derivatives containing oxygen and sulphur as he"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"1311.7022","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":""},"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":"1311.7022","created_at":"2026-05-18T01:46:05.559090+00:00"},{"alias_kind":"arxiv_version","alias_value":"1311.7022v2","created_at":"2026-05-18T01:46:05.559090+00:00"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.1311.7022","created_at":"2026-05-18T01:46:05.559090+00:00"},{"alias_kind":"pith_short_12","alias_value":"37KKODIUQADR","created_at":"2026-05-18T12:27:32.513160+00:00"},{"alias_kind":"pith_short_16","alias_value":"37KKODIUQADRU34Z","created_at":"2026-05-18T12:27:32.513160+00:00"},{"alias_kind":"pith_short_8","alias_value":"37KKODIU","created_at":"2026-05-18T12:27:32.513160+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/37KKODIUQADRU34ZYVFBE3ZNJC","json":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC.json","graph_json":"https://pith.science/api/pith-number/37KKODIUQADRU34ZYVFBE3ZNJC/graph.json","events_json":"https://pith.science/api/pith-number/37KKODIUQADRU34ZYVFBE3ZNJC/events.json","paper":"https://pith.science/paper/37KKODIU"},"agent_actions":{"view_html":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC","download_json":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC.json","view_paper":"https://pith.science/paper/37KKODIU","resolve_alias":"https://pith.science/api/pith-number/resolve?arxiv=1311.7022&json=true","fetch_graph":"https://pith.science/api/pith-number/37KKODIUQADRU34ZYVFBE3ZNJC/graph.json","fetch_events":"https://pith.science/api/pith-number/37KKODIUQADRU34ZYVFBE3ZNJC/events.json","actions":{"anchor_timestamp":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC/action/timestamp_anchor","attest_storage":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC/action/storage_attestation","attest_author":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC/action/author_attestation","sign_citation":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC/action/citation_signature","submit_replication":"https://pith.science/pith/37KKODIUQADRU34ZYVFBE3ZNJC/action/replication_record"}},"created_at":"2026-05-18T01:46:05.559090+00:00","updated_at":"2026-05-18T01:46:05.559090+00:00"}