Javad,

The code is converting your lattice vectors from Angstroms to Bohrs (watch
out for this with things like nuclear positions too). I don't know what's
going on with your recompiled grid2cube problem, but on the plus side you
can ignore it and go back to the older build that gave you the right
answer.


Edan.


> Dear SIESTA users,
> Hello and good day!
>
> I am trying to get the isosurface of a nanotube usind grid2cube tool and
LDOS.
> The problem is that I am getting wrong values for my unit-cell vectors like
>    75.58907511097422         0.000000000000000         0.000000000000000
>    0.000000000000000         56.69180633323067         0.000000000000000
>    0.000000000000000         0.000000000000000         37.24840648781031
>
>
> while my unit-cell vectors are
> 40.0000000     0.00000000      0.00000000
> 0.00000000     30.0000000      0.00000000
> 0.00000000     0.00000000      19.71100000
<snipped>

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