The LDOS file can be opened directly in WSxM program (freeware) under
Windows
Try this


2011/6/2 Ian Shuttleworth <[email protected]>

> I am tring to plot the LDOS using molekel. I dont want to use Xcrysden for
> this.
>
> I am using Siesta 3.0-b.
>
> I am currently taking the generated LDOS file and processing it using
> the attached grid2cube.f util to convert the file to CUBE format. As a
> further check, I've tried processing RHO/DRHO files using the same
> utility.
>
> Either way, the output from the grid2cube processing doesnt make
> sense. The molekel functions that I plot are, well, meaningless.
>
> The grid2cube file is the version that came bundled with siesta 3.0-b.
>
> My only guess is that maybe there has been a change in the grid format
> produced by siesta that maybe hasnt been carried across to this
> utility, though I've compared the grid2cube file with 3.0-b and it
> seems the same.
>
> Has anyone got any ideas?
>

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