mirror of https://gitlab.com/QEF/q-e.git
39 lines
1.2 KiB
Fortran
39 lines
1.2 KiB
Fortran
!
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! Copyright (C) 2001-2008 PWSCF group
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! This file is distributed under the terms of the
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! GNU General Public License. See the file `License'
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! in the root directory of the present distribution,
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! or http://www.gnu.org/copyleft/gpl.txt .
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!
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!
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!----------------------------------------------------------------------------
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SUBROUTINE allocate_wfc()
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!----------------------------------------------------------------------------
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!
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! ... dynamical allocation of arrays: wavefunctions
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! ... must be called after allocate_nlpot
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!
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USE io_global, ONLY : stdout
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USE wvfct, ONLY : npwx, nbnd
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USE basis, ONLY : natomwfc
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USE fixed_occ, ONLY : one_atom_occupations
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USE ldaU, ONLY : swfcatom, lda_plus_u
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USE noncollin_module, ONLY : noncolin, npol
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USE wavefunctions_module, ONLY : evc
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USE wannier_new, ONLY : use_wannier
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!
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IMPLICIT NONE
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!
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!
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IF (noncolin) THEN
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ALLOCATE( evc( npwx*npol, nbnd ) )
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IF ( lda_plus_u .OR. one_atom_occupations ) ALLOCATE( swfcatom( npwx*npol, natomwfc) )
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ELSE
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ALLOCATE( evc( npwx, nbnd ) )
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IF ( lda_plus_u .OR. use_wannier .OR. one_atom_occupations ) ALLOCATE( swfcatom( npwx, natomwfc) )
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ENDIF
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!
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RETURN
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!
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END subroutine allocate_wfc
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