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src/elpa2/kernels/real_simple_block4.F90 0 → 100644
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#if 0
! This file is part of ELPA.
!
! The ELPA library was originally created by the ELPA consortium,
! consisting of the following organizations:
!
! - Max Planck Computing and Data Facility (MPCDF), formerly known as
! Rechenzentrum Garching der Max-Planck-Gesellschaft (RZG),
! - Bergische Universität Wuppertal, Lehrstuhl für angewandte
! Informatik,
! - Technische Universität München, Lehrstuhl für Informatik mit
! Schwerpunkt Wissenschaftliches Rechnen ,
! - Fritz-Haber-Institut, Berlin, Abt. Theorie,
! - Max-Plack-Institut für Mathematik in den Naturwissenschaften,
! Leipzig, Abt. Komplexe Strukutren in Biologie und Kognition,
! and
! - IBM Deutschland GmbH
!
!
! More information can be found here:
! http://elpa.mpcdf.mpg.de/
!
! ELPA is free software: you can redistribute it and/or modify
! it under the terms of the version 3 of the license of the
! GNU Lesser General Public License as published by the Free
! Software Foundation.
!
! ELPA is distributed in the hope that it will be useful,
! but WITHOUT ANY WARRANTY; without even the implied warranty of
! MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
! GNU Lesser General Public License for more details.
!
! You should have received a copy of the GNU Lesser General Public License
! along with ELPA. If not, see <http://www.gnu.org/licenses/>
!
! ELPA reflects a substantial effort on the part of the original
! ELPA consortium, and we ask you to respect the spirit of the
! license that we chose: i.e., please contribute any changes you
! may have back to the original ELPA library distribution, and keep
! any derivatives of ELPA under the same license that we chose for
! the original distribution, the GNU Lesser General Public License.
!
!
! --------------------------------------------------------------------------------------------------
!
! This file contains the compute intensive kernels for the Householder transformations.
!
! This is the small and simple version (no hand unrolling of loops etc.) but for some
! compilers this performs better than a sophisticated version with transformed and unrolled loops.
!
! It should be compiled with the highest possible optimization level.
!
! Copyright of the original code rests with the authors inside the ELPA
! consortium. The copyright of any additional modifications shall rest
! with their original authors, but shall adhere to the licensing terms
! distributed along with the original code in the file "COPYING".
!
! --------------------------------------------------------------------------------------------------
#endif
#include "config-f90.h"
#ifndef USE_ASSUMED_SIZE
module real_generic_simple_block4_kernel
private
public quad_hh_trafo_real_generic_simple_4hv_double
#ifdef WANT_SINGLE_PRECISION_REAL
public quad_hh_trafo_real_generic_simple_4hv_single
#endif
contains
#endif
#define REALCASE 1
#define DOUBLE_PRECISION 1
#include "../../general/precision_macros.h"
#include "simple_block4_template.F90"
#undef REALCASE
#undef DOUBLE_PRECISION
#ifdef WANT_SINGLE_PRECISION_REAL
#define REALCASE 1
#define SINGLE_PRECISION 1
#include "../../general/precision_macros.h"
#include "simple_block4_template.F90"
#undef REALCASE
#undef SINGLE_PRECISION
#endif
#ifndef USE_ASSUMED_SIZE
end module real_generic_simple_block4_kernel
#endif
! --------------------------------------------------------------------------------------------------
src/elpa2/kernels/simple_block4_template.F90 0 → 100644
View file @ e5967820
#if 0
! This file is part of ELPA.
!
! The ELPA library was originally created by the ELPA consortium,
! consisting of the following organizations:
!
! - Max Planck Computing and Data Facility (MPCDF), formerly known as
! Rechenzentrum Garching der Max-Planck-Gesellschaft (RZG),
! - Bergische Universität Wuppertal, Lehrstuhl für angewandte
! Informatik,
! - Technische Universität München, Lehrstuhl für Informatik mit
! Schwerpunkt Wissenschaftliches Rechnen ,
! - Fritz-Haber-Institut, Berlin, Abt. Theorie,
! - Max-Plack-Institut für Mathematik in den Naturwissenschaften,
! Leipzig, Abt. Komplexe Strukutren in Biologie und Kognition,
! and
! - IBM Deutschland GmbH
!
!
! More information can be found here:
! http://elpa.mpcdf.mpg.de/
!
! ELPA is free software: you can redistribute it and/or modify
! it under the terms of the version 3 of the license of the
! GNU Lesser General Public License as published by the Free
! Software Foundation.
!
! ELPA is distributed in the hope that it will be useful,
! but WITHOUT ANY WARRANTY; without even the implied warranty of
! MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
! GNU Lesser General Public License for more details.
!
! You should have received a copy of the GNU Lesser General Public License
! along with ELPA. If not, see <http://www.gnu.org/licenses/>
!
! ELPA reflects a substantial effort on the part of the original
! ELPA consortium, and we ask you to respect the spirit of the
! license that we chose: i.e., please contribute any changes you
! may have back to the original ELPA library distribution, and keep
! any derivatives of ELPA under the same license that we chose for
! the original distribution, the GNU Lesser General Public License.
!
!
! --------------------------------------------------------------------------------------------------
!
! This file contains the compute intensive kernels for the Householder transformations.
!
! This is the small and simple version (no hand unrolling of loops etc.) but for some
! compilers this performs better than a sophisticated version with transformed and unrolled loops.
!
! It should be compiled with the highest possible optimization level.
!
! Copyright of the original code rests with the authors inside the ELPA
! consortium. The copyright of any additional modifications shall rest
! with their original authors, but shall adhere to the licensing terms
! distributed along with the original code in the file "COPYING".
!
! --------------------------------------------------------------------------------------------------
#endif
subroutine quad_hh_trafo_&
&MATH_DATATYPE&
&_generic_simple_4hv_&
&PRECISION&
& (q, hh, nb, nq, ldq, ldh)
use precision
use elpa_abstract_impl
implicit none
!class(elpa_abstract_impl_t), intent(inout) :: obj
integer(kind=ik), intent(in) :: nb, nq, ldq, ldh
#if REALCASE==1
#ifdef USE_ASSUMED_SIZE
real(kind=C_DATATYPE_KIND), intent(inout) :: q(ldq,*)
real(kind=C_DATATYPE_KIND), intent(in) :: hh(ldh,*)
#else
real(kind=C_DATATYPE_KIND), intent(inout) :: q(1:ldq,1:nb+3)
real(kind=C_DATATYPE_KIND), intent(in) :: hh(1:ldh,1:6)
#endif
real(kind=C_DATATYPE_KIND) :: s_1_2, s_1_3, s_2_3, s_1_4, s_2_4, s_3_4
real(kind=C_DATATYPE_KIND) :: vs_1_2, vs_1_3, vs_2_3, vs_1_4, vs_2_4, vs_3_4
real(kind=C_DATATYPE_KIND) :: h_2_1, h_3_2, h_3_1, h_4_3, h_4_2, h_4_1
real(kind=C_DATATYPE_KIND) :: a_1_1(nq), a_2_1(nq), a_3_1(nq), a_4_1(nq)
real(kind=C_DATATYPE_KIND) :: h1, h2, h3, h4
real(kind=C_DATATYPE_KIND) :: w(nq), z(nq), x(nq), y(nq)
real(kind=C_DATATYPE_KIND) :: tau1, tau2, tau3, tau4
#endif /* REALCASE==1 */
#if COMPLEXCASE==1
#ifdef USE_ASSUMED_SIZE
complex(kind=C_DATATYPE_KIND), intent(inout) :: q(ldq,*)
complex(kind=C_DATATYPE_KIND), intent(in) :: hh(ldh,*)
#else
complex(kind=C_DATATYPE_KIND), intent(inout) :: q(1:ldq,1:nb+3)
complex(kind=C_DATATYPE_KIND), intent(in) :: hh(1:ldh,1:6)
#endif
complex(kind=C_DATATYPE_KIND) :: s_1_2, s_1_3, s_2_3, s_1_4, s_2_4, s_3_4
complex(kind=C_DATATYPE_KIND) :: vs_1_2, vs_1_3, vs_2_3, vs_1_4, vs_2_4, vs_3_4
complex(kind=C_DATATYPE_KIND) :: h_2_1, h_3_2, h_3_1, h_4_3, h_4_2, h_4_1
complex(kind=C_DATATYPE_KIND) :: a_1_1(nq), a_2_1(nq), a_3_1(nq), a_4_1(nq)
complex(kind=C_DATATYPE_KIND) :: w(nq), z(nq), x(nq), y(nq)
complex(kind=C_DATATYPE_KIND) :: h1, h2, h3, h4
complex(kind=C_DATATYPE_KIND) :: tau1, tau2, tau3, tau4
#endif /* COMPLEXCASE==1 */
integer(kind=ik) :: i
! Calculate dot product of the two Householder vectors
#if REALCASE==1
s_1_2 = hh(2,2)
s_1_3 = hh(3,3)
s_2_3 = hh(2,3)
s_1_4 = hh(4,4)
s_2_4 = hh(3,4)
s_3_4 = hh(2,4)
s_1_2 = s_1_2 + hh(2,1) * hh(3,2)
s_2_3 = s_2_3 + hh(2,2) * hh(3,3)
s_3_4 = s_3_4 + hh(2,3) * hh(3,4)
s_1_2 = s_1_2 + hh(3,1) * hh(4,2)
s_2_3 = s_2_3 + hh(3,2) * hh(4,3)
s_3_4 = s_3_4 + hh(3,3) * hh(4,4)
s_1_3 = s_1_3 + hh(2,1) * hh(4,3)
s_2_4 = s_2_4 + hh(2,2) * hh(4,4)
!DIR$ IVDEP
do i=5,nb
s_1_2 = s_1_2 + hh(i-1,1) * hh(i,2)
s_2_3 = s_2_3 + hh(i-1,2) * hh(i,3)
s_3_4 = s_3_4 + hh(i-1,3) * hh(i,4)
s_1_3 = s_1_3 + hh(i-2,1) * hh(i,3)
s_2_4 = s_2_4 + hh(i-2,2) * hh(i,4)
s_1_4 = s_1_4 + hh(i-3,1) * hh(i,4)
enddo
#endif
#if COMPLEXCASE==1
stop
!s = conjg(hh(2,2))*1.0
!do i=3,nb
! s = s+(conjg(hh(i,2))*hh(i-1,1))
!enddo
#endif
! Do the Householder transformations
a_1_1(1:nq) = q(1:nq,4)
a_2_1(1:nq) = q(1:nq,3)
a_3_1(1:nq) = q(1:nq,2)
a_4_1(1:nq) = q(1:nq,1)
h_2_1 = hh(2,2)
h_3_2 = hh(2,3)
h_3_1 = hh(3,3)
h_4_3 = hh(2,4)
h_4_2 = hh(3,4)
h_4_1 = hh(4,4)
#if REALCASE == 1
w(1:nq) = a_3_1(1:nq) * h_4_3 + a_4_1(1:nq)
w(1:nq) = a_2_1(1:nq) * h_4_2 + w(1:nq)
w(1:nq) = a_1_1(1:nq) * h_4_1 + w(1:nq)
z(1:nq) = a_2_1(1:nq) * h_3_2 + a_3_1(1:nq)
z(1:nq) = a_1_1(1:nq) * h_3_1 + z(1:nq)
y(1:nq) = a_1_1(1:nq) * h_2_1 + a_2_1(1:nq)
x(1:nq) = a_1_1(1:nq)
#endif
#if COMPLEXCASE==1
stop
!y(1:nq) = q(1:nq,1) + q(1:nq,2)*conjg(hh(2,2))
#endif
do i=5,nb
#if REALCASE == 1
h1 = hh(i-3,1)
h2 = hh(i-2,2)
h3 = hh(i-1,3)
h4 = hh(i ,4)
#endif
#if COMPLEXCASE==1
stop
! h1 = conjg(hh(i-1,1))
! h2 = conjg(hh(i,2))
#endif
x(1:nq) = x(1:nq) + q(1:nq,i) * h1
y(1:nq) = y(1:nq) + q(1:nq,i) * h2
z(1:nq) = z(1:nq) + q(1:nq,i) * h3
w(1:nq) = w(1:nq) + q(1:nq,i) * h4
enddo
h1 = hh(nb-2,1)
h2 = hh(nb-1,2)
h3 = hh(nb ,3)
#if REALCASE==1
x(1:nq) = x(1:nq) + q(1:nq,nb+1) * h1
y(1:nq) = y(1:nq) + q(1:nq,nb+1) * h2
z(1:nq) = z(1:nq) + q(1:nq,nb+1) * h3
#endif
#if COMPLEXCASE==1
stop
!x(1:nq) = x(1:nq) + q(1:nq,nb+1)*conjg(hh(nb,1))
#endif
h1 = hh(nb-1,1)
h2 = hh(nb ,2)
x(1:nq) = x(1:nq) + q(1:nq,nb+2) * h1
y(1:nq) = y(1:nq) + q(1:nq,nb+2) * h2
h1 = hh(nb,1)
x(1:nq) = x(1:nq) + q(1:nq,nb+3) * h1
! Rank-1 update
tau1 = hh(1,1)
tau2 = hh(1,2)
tau3 = hh(1,3)
tau4 = hh(1,4)
vs_1_2 = s_1_2
vs_1_3 = s_1_3
vs_2_3 = s_2_3
vs_1_4 = s_1_4
vs_2_4 = s_2_4
vs_3_4 = s_3_4
h1 = tau1
x(1:nq) = x(1:nq) * h1
h1 = tau2
h2 = tau2 * vs_1_2
y(1:nq) = y(1:nq) * h1 - x(1:nq) * h2
h1 = tau3
h2 = tau3 * vs_1_3
h3 = tau3 * vs_2_3
z(1:nq) = z(1:nq) * h1 - (y(1:nq) * h3 + x(1:nq) * h2)
h1 = tau4
h2 = tau4 * vs_1_4
h3 = tau4 * vs_2_4
h4 = tau4 * vs_3_4
w(1:nq) = w(1:nq) * h1 - ( z(1:nq) * h4 + y(1:nq) * h3 + x(1:nq) * h2)
q(1:nq,1) = q(1:nq,1) - w(1:nq)
h4 = hh(2,4)
q(1:nq,2) = q(1:nq,2) - (w(1:nq) * h4 + z(1:nq))
h3 = hh(2,3)
h4 = hh(3,4)
q(1:nq,3) = q(1:nq,3) - y(1:nq)
q(1:nq,3) = -( z(1:nq) * h3) + q(1:nq,3)
q(1:nq,3) = -( w(1:nq) * h4) + q(1:nq,3)
h2 = hh(2,2)
h3 = hh(3,3)
h4 = hh(4,4)
q(1:nq,4) = q(1:nq,4) - x(1:nq)
q(1:nq,4) = -(y(1:nq) * h2) + q(1:nq,4)
q(1:nq,4) = -(z(1:nq) * h3) + q(1:nq,4)
q(1:nq,4) = -(w(1:nq) * h4) + q(1:nq,4)
do i=5,nb
h1 = hh(i-3,1)
h2 = hh(i-2,2)
h3 = hh(i-1,3)
h4 = hh(i ,4)
q(1:nq,i) = -(x(1:nq) * h1) + q(1:nq,i)
q(1:nq,i) = -(y(1:nq) * h2) + q(1:nq,i)
q(1:nq,i) = -(z(1:nq) * h3) + q(1:nq,i)
q(1:nq,i) = -(w(1:nq) * h4) + q(1:nq,i)
enddo
h1 = hh(nb-2,1)
h2 = hh(nb-1,2)
h3 = hh(nb ,3)
q(1:nq,nb+1) = -(x(1:nq) * h1) + q(1:nq,nb+1)
q(1:nq,nb+1) = -(y(1:nq) * h2) + q(1:nq,nb+1)
q(1:nq,nb+1) = -(z(1:nq) * h3) + q(1:nq,nb+1)
h1 = hh(nb-1,1)
h2 = hh(nb ,2)
q(1:nq,nb+2) = - (x(1:nq) * h1) + q(1:nq,nb+2)
q(1:nq,nb+2) = - (y(1:nq) * h2) + q(1:nq,nb+2)
h1 = hh(nb,1)
q(1:nq,nb+3) = - (x(1:nq) * h1) + q(1:nq,nb+3)
end subroutine
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