{"state_type":"pith_open_graph_state","state_version":"1.0","pith_number":"pith:2022:SQVDQFUSVYTHYUGA43EXTVO6LF","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":"0e5a5cf0a989ffe2ea0683b6d109fe9df263f7ecec98edd3f85c9d1e46bba6ad","cross_cats_sorted":[],"license":"http://creativecommons.org/licenses/by/4.0/","primary_cat":"cs.LG","submitted_at":"2022-05-28T00:01:30Z","title_canon_sha256":"635a85f39e06e8cdd0434337c3f1e6ec9766a842173b2541b3209483ce2eec5c"},"schema_version":"1.0","source":{"id":"2205.14276","kind":"arxiv","version":3}},"source_aliases":[{"alias_kind":"arxiv","alias_value":"2205.14276","created_at":"2026-07-05T05:31:14Z"},{"alias_kind":"arxiv_version","alias_value":"2205.14276v3","created_at":"2026-07-05T05:31:14Z"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.2205.14276","created_at":"2026-07-05T05:31:14Z"},{"alias_kind":"pith_short_12","alias_value":"SQVDQFUSVYTH","created_at":"2026-07-05T05:31:14Z"},{"alias_kind":"pith_short_16","alias_value":"SQVDQFUSVYTHYUGA","created_at":"2026-07-05T05:31:14Z"},{"alias_kind":"pith_short_8","alias_value":"SQVDQFUS","created_at":"2026-07-05T05:31:14Z"}],"graph_snapshots":[{"event_id":"sha256:d8a06e0c0c912a495f8a4552d5177e891c146a437c6c4fba88823475feb6e3c6","target":"graph","created_at":"2026-07-05T05:31:14Z","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"},"integrity":{"available":true,"clean":true,"detectors_run":[],"endpoint":"/pith/2205.14276/integrity.json","findings":[],"snapshot_sha256":"c28c3603d3b5d939e8dc4c7e95fa8dfce3d595e45f758748cecf8e644a296938","summary":{"advisory":0,"by_detector":{},"critical":0,"informational":0}},"paper":{"abstract_excerpt":"The application of machine learning methods in quantum chemistry has enabled the study of numerous chemical phenomena, which are computationally intractable with traditional ab-initio methods. However, some quantum mechanical properties of molecules and materials depend on non-local electronic effects, which are often neglected due to the difficulty of modeling them efficiently. This work proposes a modified attention mechanism adapted to the underlying physics, which allows to recover the relevant non-local effects. Namely, we introduce spherical harmonic coordinates (SPHCs) to reflect higher","authors_text":"J. Thorben Frank, Klaus-Robert M\\\"uller, Oliver T. Unke","cross_cats":[],"headline":"","license":"http://creativecommons.org/licenses/by/4.0/","primary_cat":"cs.LG","submitted_at":"2022-05-28T00:01:30Z","title":"So3krates: Equivariant attention for interactions on arbitrary length-scales in molecular systems"},"references":{"count":0,"internal_anchors":0,"resolved_work":0,"sample":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"2205.14276","kind":"arxiv","version":3},"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":"sha256:6cd7ef1f2a35aeb7c817fdca2bf8441cf1b1b1913bcbdc206ac69adeff13649d","target":"record","created_at":"2026-07-05T05:31:14Z","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":"0e5a5cf0a989ffe2ea0683b6d109fe9df263f7ecec98edd3f85c9d1e46bba6ad","cross_cats_sorted":[],"license":"http://creativecommons.org/licenses/by/4.0/","primary_cat":"cs.LG","submitted_at":"2022-05-28T00:01:30Z","title_canon_sha256":"635a85f39e06e8cdd0434337c3f1e6ec9766a842173b2541b3209483ce2eec5c"},"schema_version":"1.0","source":{"id":"2205.14276","kind":"arxiv","version":3}},"canonical_sha256":"942a381692ae267c50c0e6c979d5de59503cc8929a1de0d2db2db00dea70ecb5","receipt":{"algorithm":"ed25519","builder_version":"pith-number-builder-2026-05-17-v1","canonical_sha256":"942a381692ae267c50c0e6c979d5de59503cc8929a1de0d2db2db00dea70ecb5","first_computed_at":"2026-07-05T05:31:14.815024Z","key_id":"pith-v1-2026-05","kind":"pith_receipt","last_reissued_at":"2026-07-05T05:31:14.815024Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54","receipt_version":"0.3","signature_b64":"9ZYNr0viAUVy9qGmIztiIQRWyXrNanQTUQLpJnBZdPN92WcnsQr38huroCW9QS+AeCwBIcP1VXQn8ytrFB2HAQ==","signature_status":"signed_v1","signed_at":"2026-07-05T05:31:14.815479Z","signed_message":"canonical_sha256_bytes"},"source_id":"2205.14276","source_kind":"arxiv","source_version":3}}},"equivocations":[],"invalid_events":[],"applied_event_ids":["sha256:6cd7ef1f2a35aeb7c817fdca2bf8441cf1b1b1913bcbdc206ac69adeff13649d","sha256:d8a06e0c0c912a495f8a4552d5177e891c146a437c6c4fba88823475feb6e3c6"],"state_sha256":"a6d9186a4f423002e7ee52918cf6f25551cb0db7ebd8a25cdc9254ff25480d1e"}