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alexm committed 2026-10-11 23:45:29 -04:00
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{"format":"scienting-dataset/1","id":"ds-hale-bond-params","name":"hale-bond-params","resources":[{"encoding":"utf-8","format":"csv","name":"bond-parameters","origin":{"anchors":"anchors.jsonl","kind":"reported"},"path":"data.csv","schema":{"fields":[{"name":"key","type":"string"},{"name":"bond","type":"string"},{"name":"set","type":"string"},{"name":"k_r","type":"number","unit":"kcal / mol / angstrom ** 2"},{"name":"r_eq","type":"number","uncertainty":{"kind":"unknown"},"unit":"angstrom"}],"primaryKey":"key"}}],"title":"Harmonic bond parameters reported in Table 1"}