Nick Papior

Results 305 comments of Nick Papior

> What do I have to do to test changes in fortran sources? Reinstall sisl again? Yes, it is fastest locally, and fortran codes are quite fast to compile, so...

Yes, if all you do is change the `wfsx_read.f90` source file, then all you need is to re-install the code to ensure it gets compiled. This should also be trivially...

Oh, and check the `_gfSile` which contains the file handle. The `wfsx_read.f90` should be changed quite a bit to store file unit from fortran. In that way you can have...

> Also, I've done a quick search to know if direct accessing is a possibility (i.e. going directly to the part of the file where the WF that we want...

But what about end-users who don't really know the difference? I am a bit worried that users will confuse the two. Could we perhaps have a middle ground `sdisplay` or...

> Ok, I understand that it is hard to objectively draw a hard line between what is a GUI and what is not. The main problem is probably that we...

Alternatively the command `sisl` could be used to dispatch _any_ functionality? ```bash sisl geometry/geom siesta.XV siesta.fdf sisl plotly RUN.fdf sisl blender Rho.grid.nc sisl ase RUN.fdf ``` or the likes?

> > Would you be very much against having sgui as the cli for everything? > > In my opinion it is not intuitive that `sgui struct.bands` will give you...

> Ok, maybe we could provide a way to switch on/off the shortcuts (e.g. splot, sgeom) within sisl so that users don't need to do it themselves? Believe it or...

Hmm, we could do that, it would requires us to hook into the `setuptools` method for creating cli's I think. Hmm, I am not a fan of this (lots of...