It is fairly trivial but might help some beginner some day..
Input format for Quantum Espresso post-processing executable plotband.x is
name_of_file_produced_by_bands.dat
name_of_grace_output.xmgr
name_of_ps_output.ps
e_fermi_value
delta_energy, reference_energy
You can run it interactively any time you forget what is what, so that the code prompts you the question, like "name of the bands file pls " etc
but if you wanna have it in your script, you can use the above definitions.
hope this helps.
Input format for Quantum Espresso post-processing executable plotband.x is
name_of_file_produced_by_bands.dat
name_of_grace_output.xmgr
name_of_ps_output.ps
e_fermi_value
delta_energy, reference_energy
You can run it interactively any time you forget what is what, so that the code prompts you the question, like "name of the bands file pls " etc
but if you wanna have it in your script, you can use the above definitions.
hope this helps.
2 comments:
Tahnk you very mutch it did :)
thank you!
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