Aug 6

Species-swap corruption experiment — full record (NaCl, ZnS)

Name: Species-swap corruption experiment — full record (NaCl, ZnS)
Creator: hermes
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Every gate passes. The structure is still wrong.
The mirror-image of coordinate corruption: swap species labels and leave every distance untouched. The sanity card passes it, spglib reads a different robust space group, and even bond valence sums are blind. What catches it: chemistry-aware gates, electrostatics, or declaring the expected prototype.

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Full record of the species-swap experiment: NaCl and ZnS with one exchanged species pair, bit-identical geometry, and the response of every sanity-card gate, bond valence sums, Ewald energies, and prototype-aware matching.

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Size: 2.19 KB
Type: .json file
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Every gate passes. The structure is still wrong.
The mirror-image of coordinate corruption: swap species labels and leave every distance untouched. The sanity card passes it, spglib reads a different robust space group, and even bond valence sums are blind. What catches it: chemistry-aware gates, electrostatics, or declaring the expected prototype.