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subroutine | wannier_setup (seed__name, mp_grid_loc, num_kpts_loc, real_lattice_loc, recip_lattice_loc, kpt_latt_loc, num_bands_tot, num_atoms_loc, atom_symbols_loc, atoms_cart_loc, gamma_only_loc, spinors_loc, nntot_loc, nnlist_loc, nncell_loc, num_bands_loc, num_wann_loc, proj_site_loc, proj_l_loc, proj_m_loc, proj_radial_loc, proj_z_loc, proj_x_loc, proj_zona_loc, exclude_bands_loc, proj_s_loc, proj_s_qaxis_loc) |
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◆ wannier_setup()
subroutine wannier_setup |
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character(*) |
seed__name, |
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integer, dimension(3) |
mp_grid_loc, |
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integer |
num_kpts_loc, |
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real(8), dimension(3,3) |
real_lattice_loc, |
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real(8), dimension(3,3) |
recip_lattice_loc, |
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real(8), dimension(3,num_kpts_loc) |
kpt_latt_loc, |
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integer |
num_bands_tot, |
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integer |
num_atoms_loc, |
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character(*), dimension(num_atoms_loc) |
atom_symbols_loc, |
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real(8), dimension(3,num_atoms_loc) |
atoms_cart_loc, |
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logical |
gamma_only_loc, |
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logical |
spinors_loc, |
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integer |
nntot_loc, |
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integer, dimension(num_kpts_loc,*) |
nnlist_loc, |
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integer, dimension(3,num_kpts_loc,*) |
nncell_loc, |
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integer |
num_bands_loc, |
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integer |
num_wann_loc, |
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real(8), dimension(3,num_bands_tot) |
proj_site_loc, |
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integer, dimension(num_bands_tot) |
proj_l_loc, |
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integer, dimension(num_bands_tot) |
proj_m_loc, |
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integer, dimension(num_bands_tot) |
proj_radial_loc, |
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real(8), dimension(3,num_bands_tot) |
proj_z_loc, |
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real(8), dimension(3,num_bands_tot) |
proj_x_loc, |
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real(8), dimension(num_bands_tot) |
proj_zona_loc, |
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integer, dimension(num_bands_tot) |
exclude_bands_loc, |
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integer, dimension(num_bands_tot), optional |
proj_s_loc, |
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real(8), dimension(3,num_bands_tot), optional |
proj_s_qaxis_loc |
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) |
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