QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: Wisam1222 on May 21, 2021, 14:11

Title: Convert py file to xsd file
Post by: Wisam1222 on May 21, 2021, 14:11
Hello all
How can I convert my py file to xsd file?
Can you guide me for a tool for this purpose.
Best Regards
Title: Re: Convert py file to xsd file
Post by: mlee on May 28, 2021, 10:01
QuantumATK doesn't support to export the xsd. If you can convert the python file to xsd format, it will work.
Title: Re: Convert py file to xsd file
Post by: Anders Blom on June 1, 2021, 23:07
I am assuming you mean converting the atomic geometry, not the Python file itself? Can you give an example of the xsd file format you need? If so, it would be relatively easy to write some Python code to convert to it, but XSD is more like a type of file format, like XML, so there probably is no standard "XSD atomic coordinate format", at least none I know of.

You might be better off just exporting to XYZ and then importing that data somewhere else...?