IRexp: experimental infrared band lists from open literature (commercial redistributable pool)
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资源简介：
Redistributable experimental IR band lists (cm−1 peak positions), not absorbance traces, extracted from the PMC Open Access Subset and Chemotion. This version replaces the prior commercial snapshot (n = 88,545) with Hugging Face ilkhamfy/IRexp revision fc238e3b600f556045bc9a3f7a37738734620cd8 (commercial DoR n = 88,519). After correcting thousands-separators in band lists, the ≥3-band inclusion rule was reapplied (−26 rows). Duplicate integer band positions within a list were removed in place. Primary file: data/irexp_commercial.jsonl.gz. Companions: ShareAlike, non-commercial, resolved_commercial, train_no_bench_commercial; plus seen_papers.txt.gz, structure–NMR quarantine, NOTICE / licence notes, SHA256SUMS.
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Zenodo创建时间：
2026-09-28
