[Q-e-developers] Plotting many KS orbitals in one pp.x run (and more)

Leopold Talirz leopold.talirz at gmail.com
Thu Nov 10 12:20:05 CET 2016


Dear Tone,

> In addition to lsign, I suggest also to make the spin_component constant: if more components are needed it can
> be done with few pp.x calculations.
>From just the input file perspective I don't see a particular reason to handle spin_component differently than kpoint and kband. Or am I missing something?

When it comes to the implementation, however, I might end up doing what you suggest as a different code is used for spin components 1,2,3 (local_dos_mag.f90) than for 0 (local_dos.f90).

Best wishes,
Leopold



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