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potksu.f90
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! Copyright (C) 2018 T. Mueller, J. K. Dewhurst, S. Sharma and E. K. U. Gross.
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! This file is distributed under the terms of the GNU General Public License.
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! See the file COPYING for license details.
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subroutine
potksu
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use
modmain
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use
modulr
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implicit none
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! local variables
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real
(8) ts0,ts1
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call
timesec
(ts0)
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! compute the ultra long-range Coulomb potential
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call
potcoulu
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! compute the ultra long-range dipole-dipole magnetic field if required
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if
(
tbdipu
)
call
bdipoleu
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! compute the ultra long-range exchange-correlation potential and fields
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call
potxcu
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! reduce the external magnetic field if required
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if
(
reducebf
< 1.d0)
then
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bfcq
(:,:)=
bfcq
(:,:)*
reducebf
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bfcmtq
(:,:,:)=
bfcmtq
(:,:,:)*
reducebf
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end if
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call
timesec
(ts1)
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timepot
=
timepot
+ts1-ts0
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end subroutine
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bdipoleu
subroutine bdipoleu
Definition
bdipoleu.f90:7
modmain
Definition
modmain.f90:6
modmain::timepot
real(8) timepot
Definition
modmain.f90:1222
modmain::reducebf
real(8) reducebf
Definition
modmain.f90:279
modulr
Definition
modulr.f90:6
modulr::tbdipu
logical tbdipu
Definition
modulr.f90:78
modulr::bfcq
complex(8), dimension(:,:), allocatable bfcq
Definition
modulr.f90:70
modulr::bfcmtq
complex(8), dimension(:,:,:), allocatable bfcmtq
Definition
modulr.f90:72
potcoulu
subroutine potcoulu
Definition
potcoulu.f90:7
potksu
subroutine potksu
Definition
potksu.f90:7
potxcu
subroutine potxcu
Definition
potxcu.f90:7
timesec
subroutine timesec(ts)
Definition
timesec.f90:10
potksu.f90
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