Comments (2)
The recent commits us trying to add this. It seems to work, albeit rather slowly (I haven't looked at optimising it).
Note that the initial charge is only necessary to determine the delta rho.
from sisl.
This is almost done, however I can't get it to work with supercells.
I have speeded up the routine.
from sisl.
Related Issues (20)
- how can i use param_circle for graphene HOT 4
- use tocartesian HOT 11
- Change neighborfinder returns to a tuple of indices and supercell indices HOT 21
- Sisl files not available in readthedocs documentation HOT 18
- Ufuncs could support external classes HOT 4
- `Geometry ` coordinates as f-contiguous array HOT 4
- Streamlining spin/index arguments on `read_grid` methods
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- `translate2uc` should use boundary conditions (?) HOT 7
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- eigenvalues from hamiltonian in presence of magnetic field HOT 2
- Listify breaks documentation HOT 8
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- numpy 2.0 released -- need to bump stuff HOT 1
- sisl release policy HOT 6
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- sisl.viz.FatBandsPlot error in fatbands_mode = 'line/scatter' HOT 16
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from sisl.