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Merge pull request #274 from Exabyte-io/docs/SOF-7431
SOF-7431: update tutorial on spin mag bandstructure calc
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lang/en/docs/tutorials/dft/electronic/spin-magnetic-qe.md

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@@ -50,14 +50,15 @@ k-path. We can set the desired k-path via the **Important Settings** tab.
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![bands.x settings](/images/tutorials/spin-magnetic/spin-bands-x.webp "bands.x settings")
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In the final step, we add `bands.x` calculation. We are interested in
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processing one type of spin (i.e., up or down) state. We can do that by
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specifying `spin_component = 1` for **up** spin, or `spin_component = 2` for
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**down** spin. So we add two units, one to process only **up** and another to
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process **down** spin only. We update the `filbands` filenames so that the
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outputs are written to different files for up/down spins. It is recommended to
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give each unit a distinct name, otherwise, some of the generated files might be
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overwritten.
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In the final step, we add `bands.x` calculation. This step is optional, and
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used for further postprocessing of already calculated bandstructure data in the
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above steps. We are interested in processing one type of spin (i.e., up or down)
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state. We can do that by specifying `spin_component = 1` for **up** spin, or
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`spin_component = 2` for **down** spin. So we add two units, one to process only
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**up** and another to process **down** spin only. We update the `filbands`
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filenames so that the outputs are written to different files for up/down spins.
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It is recommended to give each unit a distinct name, otherwise, some of the
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generated files might be overwritten.
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## 3. Job designer
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@@ -90,6 +91,13 @@ Once the job is completed, the bandstructure plots are shown in the **Results**
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tab. All input and output files can be found in the **Files** tab and can be
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used for further analysis.
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**Updated in platform version 2024.8.22:** Both spin components (if present) are
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now shown in the same plot with different colors. Following plot shows the spin
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resolved bandstructure of nickel, where blue and orange colors represent up and
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down spin components, respectively.
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![Spin resolved bandstructure of Ni](/images/tutorials/spin-magnetic/ni-spin-resolved-bandstructure.webp "Spin resolved bandstructure of Ni")
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## Step-by-step screenshare video
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