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Patch v0.4.1#24

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ifilot merged 2 commits intomasterfrom
develop
Mar 16, 2026
Merged

Patch v0.4.1#24
ifilot merged 2 commits intomasterfrom
develop

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@ifilot ifilot commented Mar 16, 2026

Bugfix

When parsing a Hessian block from a YAML file, the program would check whether a signflip would be needed to align the results with the given frequencies. This is counterintuitive as a Hessian is well-defined. The program now assumes that the Hessian is simple a hessian and no longer considers the option it is a force derivatives matrix.

@ifilot ifilot self-assigned this Mar 16, 2026
@ifilot ifilot added the bug Something isn't working label Mar 16, 2026
@ifilot ifilot merged commit 9e73e51 into master Mar 16, 2026
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@ifilot ifilot deleted the develop branch March 16, 2026 19:23
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