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updates to Sr2RuO4_SOC #5

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updates to Sr2RuO4_SOC #5

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phibeck
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@phibeck phibeck commented Aug 2, 2024

Update to the Sr2RuO4 benchmark:

  • replacing the tight_binding_model() function by that in lattice.utils
  • SOC lambda matrix could in principle be used from dft_tools/converters/wannier90, but different orbital order so it would end up not being much shorter
  • the notebook contains results from an actual calculation, but there aren't any results in the directory, so perhaps one should update the notebook?
  • we can do this calculation in cthyb, so we should add results

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