Local Density-Of-States information. This can be used to generate STM images in the Tersoff-Hamann approximation [35].
LDOS
{ Shift eshift }
{ DeltaNeg deneg }
{ DeltaPos depos }
End
Shift: The energy bias with respect to the fermi level in a.u.. Default = 0.0
DeltaNeg Default = 1e-4 a.u.
DeltaPos Default = 1e-4
The local density of states is integrated over the interval eshift-deneg through eshift+depos.
Example of an LDOS restart:
...
Restart my.runkf &
DensityPlot
End
Grid
Type Coarse
End
DensityPlot
LDOS_scf
End
LDOS
Shift 0.1
DeltaNeg .001
DeltaPos 0
End
According to this example, we restart from the result file of a previous calculation. The calculation will generate a file TAPE41 which can be viewed with adfview. (Rename the file to my.t41)
See also Restart, and DensityPlot.




