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XRD-XRF database

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Zenodo2026-03-09 更新2026-05-26 收录
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https://zenodo.org/doi/10.5281/zenodo.18924300
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Mineral Database Description This database contains 521,901 mineral patterns extracted from the Crystallography Open Database (COD) - one of the world's largest open-access collections of crystal structures. 📈 Key Statistics Metric Value Description Total Mineral Patterns 521,901 Complete crystallographic entries with full structural data Unique Minerals/Substances 521,901 Each entry is unique (COD IDs are distinct) Crystal System Entries 467,938 89.7% of patterns have identified crystal systems Total D-Spacing Entries 10,398,667 Over 10 million diffraction peaks! Average Peaks per Pattern 19.9 Nearly all 20 possible peaks are populated Database Size 299 MB Compact, efficient storage for rapid queries 🎯 What This Database Contains Complete Mineral Information ✅ COD ID (unique identifier) ✅ Mineral/Substance name ✅ Mineral group classification ✅ Category (MINERAL, ORGANIC, OXIDE, etc.) ✅ Crystal system (triclinic to cubic) ✅ Chemical formula XRD Peak Data (20 peaks per mineral) d-spacings (Å) - The characteristic "fingerprint" of each mineral Relative intensities (%) - Normalized to 100% 10.4 million total peak measurements across all minerals 🔬 Scientific Value Feature Benefit High coverage (89.7% crystal systems) Reliable phase identification 19.9 avg peaks per mineral Excellent pattern matching accuracy All major mineral groups Complete geological coverage 299 MB optimized database Fast queries, small footprint
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2026-03-09
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