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Fix temperature units and add ASE-type functionality back into notebook #857

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Fix temperature units and add ASE-type functionality back into notebook

Fix temperature units and add ASE-type functionality back into notebook #857

Run time

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Job Run time
Python unit and integration tests
3m 29s
Type analysis for python
1m 26s
C# unit and integration tests
41s
Ruff to lint python code
1m 15s
6m 51s