RESPECTED SIR
as you told me to install oneAPI so i did it and now it is installed but
there is a problem with Wien2k previously I have Wien2k 19.01 and now I
installed Wien2k 21.1.
please tell me how to uninstall the older version so that the new one comes
into account
again there is a
With apologies to Peter, I would not say that the options are experimental.
If you are OK with handling Fortran, I suggest that you copy eramps.F then
comment out "subroutine tester" and uncomment "program tester". Then
compile run it.
Be careful that, due to truncation of the Fourier series,
I suggest you stay with the default mode (the other options are more
experimental) and put IFIELD=30.
This produces for EFELD=1.0 Ry a zig-zag potential along z of 0.5 (for
z=0), -0.5 (for z=0.5) and again 0.5 for z=1.0.
Thus you need to setup a slab with your atoms centered around z=0.25
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