WANNIER90 WIN: Difference between revisions

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[[The_VASP_Manual|Contents]]
[[The_VASP_Manual|Contents]]


[[Category:INCAR]][[Category:Wannier Functions]]
[[Category:INCAR tags]][[Category:Wannier Functions]]

Revision as of 17:10, 6 April 2022

WANNIER90_WIN = [string] 

Default: WANNIER90_WIN = None

Description: WANNIER90_WIN sets the content of the wannier90.win file.


The WANNIER90_WIN tag is a multiline string, where the content of the wannier90.win file can be specified. For instance,

WANNIER90_WIN = "
exclude_bands 17-64

Begin Projections
Si:sp3
End Projections

# Disentanglement
dis_win_min = -7
dis_win_max = 16
dis_num_iter = 100

guiding_centres = true
"

Additionally, the value of some Wannier90 tags is set automatically based on the VASP calculation, e.g., kpoints, atoms, unit_cell, mp_grid, spinors, num_bands, num_wann.

Available as of VASP 6.2.0.

Related tags and articles

NUM_WANN, LWANNIER90, LWANNIER90_RUN

Examples that use this tag


Contents