{"record_type":"pith_number_record","schema_url":"https://pith.science/schemas/pith-number/v1.json","pith_number":"pith:2014:WGU3JSZUULT5SY6SR6D6DQGSQA","short_pith_number":"pith:WGU3JSZU","schema_version":"1.0","canonical_sha256":"b1a9b4cb34a2e7d963d28f87e1c0d2803b275290dc3ef7e974953f502632fd78","source":{"kind":"arxiv","id":"1409.6245","version":1},"attestation_state":"computed","paper":{"title":"Analysis of Transition State Theory Rates upon Spatial Coarse-Graining","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"math.NA","authors_text":"Andrew Binder, Arthur F. Voter, Danny Perez, Mitchell Luskin","submitted_at":"2014-09-22T16:56:37Z","abstract_excerpt":"Spatial multiscale methods have established themselves as useful tools for extending the length scales accessible by conventional statics (i.e., zero temperature molecular dynamics). Recently, extensions of these methods, such as the finite-temperature quasicontinuum (hot-QC) or Coarse-Grained Molecular Dynamics (CGMD) methods, have allowed for multiscale molecular dynamics simulations at finite temperature. Here, we assess the quality of the long-time dynamics these methods generate by considering canonical transition rates. Specifically, we analyze the transition state theory (TST) rates in "},"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":"1409.6245","kind":"arxiv","version":1},"metadata":{"license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","primary_cat":"math.NA","submitted_at":"2014-09-22T16:56:37Z","cross_cats_sorted":[],"title_canon_sha256":"ba71c4693a5587ed374c103bed3c0fe867211a45dfb016cf41c823621960d3fd","abstract_canon_sha256":"47741b448fdbca371d8237a9b4ca34865a542f42b7d615b44d2a3da3cbb4067a"},"schema_version":"1.0"},"receipt":{"kind":"pith_receipt","key_id":"pith-v1-2026-05","algorithm":"ed25519","signed_at":"2026-05-18T02:42:13.515243Z","signature_b64":"TVNXvQdtpS17oSxfkbJnHBHTa7QEGDHKVcGhlxlbL+ow6fj9UJjJbNPviSEZxLBQuw8tdI+yU/J+MgozTLi+Ag==","signed_message":"canonical_sha256_bytes","builder_version":"pith-number-builder-2026-05-17-v1","receipt_version":"0.3","canonical_sha256":"b1a9b4cb34a2e7d963d28f87e1c0d2803b275290dc3ef7e974953f502632fd78","last_reissued_at":"2026-05-18T02:42:13.514762Z","signature_status":"signed_v1","first_computed_at":"2026-05-18T02:42:13.514762Z","public_key_fingerprint":"8d4b5ee74e4693bcd1df2446408b0d54"},"graph_snapshot":{"paper":{"title":"Analysis of Transition State Theory Rates upon Spatial Coarse-Graining","license":"http://arxiv.org/licenses/nonexclusive-distrib/1.0/","headline":"","cross_cats":[],"primary_cat":"math.NA","authors_text":"Andrew Binder, Arthur F. Voter, Danny Perez, Mitchell Luskin","submitted_at":"2014-09-22T16:56:37Z","abstract_excerpt":"Spatial multiscale methods have established themselves as useful tools for extending the length scales accessible by conventional statics (i.e., zero temperature molecular dynamics). Recently, extensions of these methods, such as the finite-temperature quasicontinuum (hot-QC) or Coarse-Grained Molecular Dynamics (CGMD) methods, have allowed for multiscale molecular dynamics simulations at finite temperature. Here, we assess the quality of the long-time dynamics these methods generate by considering canonical transition rates. Specifically, we analyze the transition state theory (TST) rates in "},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"1409.6245","kind":"arxiv","version":1},"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":"1409.6245","created_at":"2026-05-18T02:42:13.514839+00:00"},{"alias_kind":"arxiv_version","alias_value":"1409.6245v1","created_at":"2026-05-18T02:42:13.514839+00:00"},{"alias_kind":"doi","alias_value":"10.48550/arxiv.1409.6245","created_at":"2026-05-18T02:42:13.514839+00:00"},{"alias_kind":"pith_short_12","alias_value":"WGU3JSZUULT5","created_at":"2026-05-18T12:28:54.890064+00:00"},{"alias_kind":"pith_short_16","alias_value":"WGU3JSZUULT5SY6S","created_at":"2026-05-18T12:28:54.890064+00:00"},{"alias_kind":"pith_short_8","alias_value":"WGU3JSZU","created_at":"2026-05-18T12:28:54.890064+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/WGU3JSZUULT5SY6SR6D6DQGSQA","json":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA.json","graph_json":"https://pith.science/api/pith-number/WGU3JSZUULT5SY6SR6D6DQGSQA/graph.json","events_json":"https://pith.science/api/pith-number/WGU3JSZUULT5SY6SR6D6DQGSQA/events.json","paper":"https://pith.science/paper/WGU3JSZU"},"agent_actions":{"view_html":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA","download_json":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA.json","view_paper":"https://pith.science/paper/WGU3JSZU","resolve_alias":"https://pith.science/api/pith-number/resolve?arxiv=1409.6245&json=true","fetch_graph":"https://pith.science/api/pith-number/WGU3JSZUULT5SY6SR6D6DQGSQA/graph.json","fetch_events":"https://pith.science/api/pith-number/WGU3JSZUULT5SY6SR6D6DQGSQA/events.json","actions":{"anchor_timestamp":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA/action/timestamp_anchor","attest_storage":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA/action/storage_attestation","attest_author":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA/action/author_attestation","sign_citation":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA/action/citation_signature","submit_replication":"https://pith.science/pith/WGU3JSZUULT5SY6SR6D6DQGSQA/action/replication_record"}},"created_at":"2026-05-18T02:42:13.514839+00:00","updated_at":"2026-05-18T02:42:13.514839+00:00"}