The Elk Code
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writegwsf.f90
Go to the documentation of this file.
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! Copyright (C) 2016 A. Davydov, A. Sanna, J. K. Dewhurst, S. Sharma and
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! E. K. U. Gross. This file is distributed under the terms of the GNU General
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! Public License. See the file COPYING for license details.
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subroutine
writegwsf
(ik,wr,sf)
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use
modmain
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use
modgw
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implicit none
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! arguments
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integer
,
intent(in)
:: ik
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real
(8),
intent(in)
:: wr(nwplot),sf(nwplot)
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! local variables
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integer
iw,ist
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real
(8) e
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character(256)
fname
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write
(fname,
'("GWSF_K",I6.6,".OUT")'
) ik
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open
(50,file=trim(fname),form=
'FORMATTED'
)
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! write the GW spectral function
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do
iw=1,nwplot
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write
(50,
'(2G18.10)'
) wr(iw),sf(iw)
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end do
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write
(50,*)
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! write the Kohn-Sham eigenvalues for reference
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do
ist=1,
nstsv
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e=
evalsv
(ist,ik)-
efermi
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write
(50,
'(2G18.10)'
) e,0.d0
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write
(50,
'(2G18.10)'
) e,1.d0/
swidth
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write
(50,*)
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end do
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close
(50)
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end subroutine
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modgw
Definition
modgw.f90:6
modmain
Definition
modmain.f90:6
modmain::efermi
real(8) efermi
Definition
modmain.f90:904
modmain::swidth
real(8) swidth
Definition
modmain.f90:892
modmain::nstsv
integer nstsv
Definition
modmain.f90:886
modmain::evalsv
real(8), dimension(:,:), allocatable evalsv
Definition
modmain.f90:918
writegwsf
subroutine writegwsf(ik, wr, sf)
Definition
writegwsf.f90:7
writegwsf.f90
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