triFS Program

Uses

Triangulate Fermi surface.

Details

Input parameters

&input
    outdir = 'directory'
    prefix = 'prefix'
    TR_symmetry = T or F
/
&tri_FS
    n1           = integer
    n2           = integer
    n3           = integer
    volume_nodes = T or F
    volnodfac    = real
    hr_file      = 'file'
    ef           = real
    verbose      = T or F
    plot_BZ      = T or F
    dos          = T or F
    eps_dupv     = real
/
&FS_opt
    collapse          = T or F
    collapse_criteria = real
    relax             = T or F
    relax_iter        = integer
    newton_raphson    = 0: not applied, 1: only in the end, 2: beginning and end
    newton_iter       = integer
    relax_vinface     = T or F
    eps_vinface       = real
/

triFS.x utility uses special tri_FS and FS_opt namelists, see triFS_input_parameters module for the description of each parameter in those namelists. See intw_input_parameters module for the description of each parameter in the input namelist.