{"state_type":"pith_open_graph_state","state_version":"1.0","pith_number":"pith:2017:GTRHAG47ZQEO62YGBGQL3RAI4T","merge_version":"pith-open-graph-merge-v1","event_count":2,"valid_event_count":2,"invalid_event_count":0,"equivocation_count":0,"current":{"canonical_record":{"metadata":{"abstract_canon_sha256":"b0416fb06b08bbf4b81ee4f9e7993b810f69865c386f56bd9d56dd0a5d80095d","cross_cats_sorted":["cond-mat.mtrl-sci"],"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"cond-mat.mes-hall","submitted_at":"2017-03-06T18:00:04Z","title_canon_sha256":"547cd29daad44aa67f6d3f68f19e0c5c7c97acf423138643f403958eee61781d"},"schema_version":"1.0","source":{"id":"1703.02004","kind":"arxiv","version":1}},"source_aliases":[{"alias_kind":"arxiv","alias_value":"1703.02004","created_at":"2026-05-18T00:49:25Z"},{"alias_kind":"arxiv_version","alias_value":"1703.02004v1","created_at":"2026-05-18T00:49:25Z"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.1703.02004","created_at":"2026-05-18T00:49:25Z"},{"alias_kind":"pith_short_12","alias_value":"GTRHAG47ZQEO","created_at":"2026-05-18T12:31:18Z"},{"alias_kind":"pith_short_16","alias_value":"GTRHAG47ZQEO62YG","created_at":"2026-05-18T12:31:18Z"},{"alias_kind":"pith_short_8","alias_value":"GTRHAG47","created_at":"2026-05-18T12:31:18Z"}],"graph_snapshots":[{"event_id":"sha256:c7793a5e21e0803f54d1302572d04857096d86ed4ae0e762ce6295e71a897acd","target":"graph","created_at":"2026-05-18T00:49:25Z","signer":{"key_id":"pith-v1-2026-05","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54","signer_id":"pith.science","signer_type":"pith_registry"},"payload":{"graph_snapshot":{"author_claims":{"count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57","strong_count":0},"builder_version":"pith-number-builder-2026-05-17-v1","claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"formal_canon":{"evidence_count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"paper":{"abstract_excerpt":"The alignment of the frontier orbital energies of an adsorbed molecule with the substrate Fermi level at metal-organic interfaces is a fundamental observable of significant practical importance in nanoscience and beyond. Typical density functional theory calculations, especially those using local and semi-local functionals, often underestimate level alignment leading to inaccurate electronic structure and charge transport properties. In this work, we develop a new fully self-consistent predictive scheme to accurately compute level alignment at certain classes of complex heterogeneous molecule-","authors_text":"David A. Egger, Jeffrey B. Neaton, Leeor Kronik, Sivan Refaely-Abramson, Zhenfei Liu","cross_cats":["cond-mat.mtrl-sci"],"headline":"","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"cond-mat.mes-hall","submitted_at":"2017-03-06T18:00:04Z","title":"Energy Level Alignment at Molecule-Metal Interfaces from an Optimally-Tuned Range-Separated Hybrid Functional"},"references":{"count":0,"internal_anchors":0,"resolved_work":0,"sample":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"1703.02004","kind":"arxiv","version":1},"verdict":{"created_at":null,"id":null,"model_set":{},"one_line_summary":"","pipeline_version":null,"pith_extraction_headline":"","strongest_claim":"","weakest_assumption":""}},"verdict_id":null}}],"author_attestations":[],"timestamp_anchors":[],"storage_attestations":[],"citation_signatures":[],"replication_records":[],"corrections":[],"mirror_hints":[],"record_created":{"event_id":"sha256:ce269d34ec5dfc2dec81c536d6ec28c6463895488cca3a350371275854212e47","target":"record","created_at":"2026-05-18T00:49:25Z","signer":{"key_id":"pith-v1-2026-05","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54","signer_id":"pith.science","signer_type":"pith_registry"},"payload":{"attestation_state":"computed","canonical_record":{"metadata":{"abstract_canon_sha256":"b0416fb06b08bbf4b81ee4f9e7993b810f69865c386f56bd9d56dd0a5d80095d","cross_cats_sorted":["cond-mat.mtrl-sci"],"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"cond-mat.mes-hall","submitted_at":"2017-03-06T18:00:04Z","title_canon_sha256":"547cd29daad44aa67f6d3f68f19e0c5c7c97acf423138643f403958eee61781d"},"schema_version":"1.0","source":{"id":"1703.02004","kind":"arxiv","version":1}},"canonical_sha256":"34e2701b9fcc08ef6b0609a0bdc408e4f40b0e5b5e7523a0e7437c7023bfe959","receipt":{"algorithm":"ed25519","builder_version":"pith-number-builder-2026-05-17-v1","canonical_sha256":"34e2701b9fcc08ef6b0609a0bdc408e4f40b0e5b5e7523a0e7437c7023bfe959","first_computed_at":"2026-05-18T00:49:25.626345Z","key_id":"pith-v1-2026-05","kind":"pith_receipt","last_reissued_at":"2026-05-18T00:49:25.626345Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54","receipt_version":"0.3","signature_b64":"bxP+kho9ukdAKsW3f5ygKb83AAG8ciFmRFFGQXtOT5JjGYSPJlRbI6fA0FQWr4kCG0oLpnO4KeJSm5hWo5hLCg==","signature_status":"signed_v1","signed_at":"2026-05-18T00:49:25.627022Z","signed_message":"canonical_sha256_bytes"},"source_id":"1703.02004","source_kind":"arxiv","source_version":1}}},"equivocations":[],"invalid_events":[],"applied_event_ids":["sha256:ce269d34ec5dfc2dec81c536d6ec28c6463895488cca3a350371275854212e47","sha256:c7793a5e21e0803f54d1302572d04857096d86ed4ae0e762ce6295e71a897acd"],"state_sha256":"7286987a45a7bafcdf8888815d13fef4ce0e9c7d75f8d2a19d8ecb0f28c54db6"}