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Support the .XRDML files produced by St Andrews ADS to FDS conversion. - #366

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@MaxPelly

@MaxPelly MaxPelly commented Oct 5, 2026

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Support the .XRDML files produced by St Andrews ADS to FDS conversion. Adds .XRDML as a supported extension and make the sample variable optional.

We've always just used powdll to convert the XRDML files but was doing some work with @dafda1 and we noticed the files are actually essentially identical.
Example XRDMLs.zip

A few changes to support the converted FDS .XRDML files produced by the university of St Andrews school of chemistry PXRD department. Adds .XRDML as an allowed extension and makes the sample  variable optional.
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