mirror of https://gitlab.com/QEF/q-e.git
26 lines
684 B
Fortran
26 lines
684 B
Fortran
!
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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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subroutine estimate (hessm1, nax3, nat, nat3)
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!-----------------------------------------------------------------------
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!
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use parameters
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implicit none
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integer :: nax3, nat3, nat, i
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real(kind=DP) :: hessm1 (nax3, nat3)
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external setv
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call setv (nax3 * nat3, 0.d0, hessm1, 1)
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do i = 1, nat3
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hessm1 (i, i) = 1.d0
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enddo
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return
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end subroutine estimate
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