Static screening: Difference between revisions
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Create the input file: | Create the input file: | ||
$ yambo -F 02_Ws.in -b -k hartree | $ yambo -F 02_Ws.in -b -k hartree (for a 3D material) | ||
or | or | ||
$ yambo -F 02_Ws.in -b -k hartree -r (for a 2D) | $ yambo -F 02_Ws.in -b -k hartree -r (for a 2D) | ||
Revision as of 10:53, 16 March 2017
Static screening matrix
Create the input file:
$ yambo -F 02_Ws.in -b -k hartree (for a 3D material)
or
$ yambo -F 02_Ws.in -b -k hartree -r (for a 2D)
Open the input file Change the size in G-space and the bands of the polarization function as:
% BndsRnXs 1 | 40 | # [Xs] Polarization function bands % NGsBlkXs= 2 Ry # [Xs] Response block size
Close the input and run the code
$ yambo -F 02_Ws.in