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@@ -36,13 +36,10 @@ Minimal JAX/Flax transformer for catalyst structure generation with single-param
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  |--------|--------|
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  | Parseable | 96/100 |
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  | Element Match | 96/100 |
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- | Generation Validity | 96/100 (96.0%) |
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- | Strict Validity‡ | 83/100 (83.0%) |
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- | Uniqueness | 83/83 (100.0%) |
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- | Novelty | 83/83 (100.0%) |
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-
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- † CatGPT criteria: parseable + volume > 1ų + cell params > 0.5.
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- ‡ Ours: + min interatomic distance ≥ 0.5Å.
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  ## Usage
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  |--------|--------|
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  | Parseable | 96/100 |
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  | Element Match | 96/100 |
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+ | Generation Validity | 96/100 (96.0%) |
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+ | Uniqueness | 96/96 (100.0%) |
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+ | Novelty | 96/96 (100.0%) |
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+ | Min Distance (≥ 0.5Å) | 83/96 (86.5%) |
 
 
 
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  ## Usage
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