2003-01-20 05:58:50 +08:00
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!
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! Copyright (C) 2001 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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2003-02-08 00:04:36 +08:00
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subroutine write_dyn_on_file (xq, phi, nat, iudyn)
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2003-01-20 05:58:50 +08:00
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!-----------------------------------------------------------------------
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2004-01-23 23:08:03 +08:00
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USE kinds, only : DP
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2003-02-08 00:04:36 +08:00
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implicit none
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2003-01-20 05:58:50 +08:00
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! input variables
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2003-02-08 00:04:36 +08:00
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integer :: iudyn, nat
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2003-01-20 05:58:50 +08:00
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! unit number
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! number of atom in the unit cell
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2003-02-08 00:04:36 +08:00
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complex(kind=DP) :: phi (3, 3, nat, nat)
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2003-01-20 05:58:50 +08:00
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! the dynamical matrix
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real(kind=DP) :: xq (3)
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2003-01-20 05:58:50 +08:00
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! the q vector
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! local variables
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2003-02-08 00:04:36 +08:00
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integer :: na, nb, icar, jcar
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2003-01-20 05:58:50 +08:00
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! counters on atoms
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! cartesian coordinate counters
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2003-02-08 00:04:36 +08:00
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write (iudyn, 9000) (xq (icar), icar = 1, 3)
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do na = 1, nat
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do nb = 1, nat
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write (iudyn, '(2i3)') na, nb
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do icar = 1, 3
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2003-01-20 05:58:50 +08:00
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write (iudyn, '(3e24.12)') (phi (icar, jcar, na, nb) , jcar = 1, &
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3)
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enddo
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enddo
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enddo
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2003-02-08 00:04:36 +08:00
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return
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2003-01-20 05:58:50 +08:00
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9000 format(/,5x,'Dynamical Matrix in cartesian axes', &
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& //,5x,'q = ( ',3f14.9,' ) ',/)
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end subroutine write_dyn_on_file
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