Example: Applying a homogeneous electric field

Download EField.run

With the EFIELD keyword you can specify a static electric field in the z-direction.

$ADFBIN/band << eor
DefaultsConvention 2014

Title Electric Field (field in a.u.)

EField
   Unit a.u.
   eZ=0.03
end

KSpace 1

Gradients
End

lattice
   15.0  0.00  0.00
   0.00  15.0  0.00
End

Atoms
   H   0.0 0.0 0.0
   Li  0.0 1.0 3.0
End

BasisDefaults
   BasisType TZP
   Core Large
End

end input
eor