SOF-7063: new documentation on DFT+U and Hubbard parameter calculation #262
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| # DFT+U and Hubbard parameter calculation in Quantum Espresso | |||
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| The electronic structure of materials consisting of transition metals (which | |||
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I'd omit this paragraph - let's just be factual about HOW to execute this instead and leave the explanation of WHY outside of the documentation. Otherwise, there's a lot more to be written regarding when DFT+U should and should not be used.
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✅ Deploy Preview for mat3ra ready!
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| to use old syntax, please select Quantum Espresso version `7.0` or below, | ||
| and use **pw_scf_dft_u_legacy**. | ||
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| 1. Navigate to workflow page from the sidebar, and create new workflow. Expand |
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Let's add a bit more explanation, headers as breakpoint, and visuals similar https://deploy-preview-262--mat3ra.netlify.app/tutorials/dft/electronic/density-of-states/
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timurbazhirov
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SOF-7063: new documentation on DFT+U and Hubbard parameter calculation
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Preview: https://deploy-preview-262--mat3ra.netlify.app/tutorials/dft/electronic/hubbard/