2021-09-07 16:36:26 +02:00
|
|
|
#+TITLE: BLAS functions
|
|
|
|
#+SETUPFILE: ../tools/theme.setup
|
|
|
|
#+INCLUDE: ../tools/lib.org
|
|
|
|
|
|
|
|
* Headers :noexport:
|
|
|
|
#+begin_src elisp :noexport :results none
|
|
|
|
(org-babel-lob-ingest "../tools/lib.org")
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
#+begin_src c :comments link :tangle (eval c_test) :noweb yes
|
|
|
|
#include "qmckl.h"
|
|
|
|
#include "assert.h"
|
|
|
|
#ifdef HAVE_CONFIG_H
|
|
|
|
#include "config.h"
|
|
|
|
#endif
|
|
|
|
int main() {
|
|
|
|
qmckl_context context;
|
|
|
|
context = qmckl_context_create();
|
|
|
|
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
* Matrix operations
|
|
|
|
|
|
|
|
** ~qmckl_dgemm~
|
|
|
|
|
2021-10-14 21:53:00 +02:00
|
|
|
Matrix multiply: $C_{ij} = \beta C_{ij} + \alpha \sum_{k} A_{ik} \cdot B_{kj}$ using Fortran ~matmul~ function.
|
|
|
|
|
2021-09-07 16:43:25 +02:00
|
|
|
TODO: Add description about the external library dependence.
|
2021-09-07 16:36:26 +02:00
|
|
|
|
|
|
|
#+NAME: qmckl_dgemm_args
|
|
|
|
| qmckl_context | context | in | Global state |
|
|
|
|
| bool | TransA | in | Number of rows of the input matrix |
|
|
|
|
| bool | TransB | in | Number of rows of the input matrix |
|
|
|
|
| int64_t | m | in | Number of rows of the input matrix |
|
|
|
|
| int64_t | n | in | Number of columns of the input matrix |
|
|
|
|
| int64_t | k | in | Number of columns of the input matrix |
|
|
|
|
| double | alpha | in | Number of columns of the input matrix |
|
|
|
|
| double | A[][lda] | in | Array containing the $m \times n$ matrix $A$ |
|
|
|
|
| int64_t | lda | in | Leading dimension of array ~A~ |
|
|
|
|
| double | B[][ldb] | in | Array containing the $n \times m$ matrix $B$ |
|
|
|
|
| int64_t | ldb | in | Leading dimension of array ~B~ |
|
|
|
|
| double | beta | in | Array containing the $n \times m$ matrix $B$ |
|
|
|
|
| double | C[][ldc] | out | Array containing the $n \times m$ matrix $B$ |
|
|
|
|
| int64_t | ldc | in | Leading dimension of array ~B~ |
|
2021-10-14 21:53:00 +02:00
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
*** Requirements
|
|
|
|
|
|
|
|
- ~context~ is not ~QMCKL_NULL_CONTEXT~
|
|
|
|
- ~m > 0~
|
|
|
|
- ~n > 0~
|
|
|
|
- ~k > 0~
|
|
|
|
- ~lda >= m~
|
|
|
|
- ~ldb >= n~
|
|
|
|
- ~ldc >= n~
|
|
|
|
- ~A~ is allocated with at least $m \times k \times 8$ bytes
|
|
|
|
- ~B~ is allocated with at least $k \times n \times 8$ bytes
|
|
|
|
- ~C~ is allocated with at least $m \times n \times 8$ bytes
|
2021-10-07 14:13:40 +02:00
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
*** C header
|
|
|
|
|
|
|
|
#+CALL: generate_c_header(table=qmckl_dgemm_args,rettyp="qmckl_exit_code",fname="qmckl_dgemm")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+BEGIN_src c :tangle (eval h_func) :comments org
|
|
|
|
qmckl_exit_code qmckl_dgemm (
|
|
|
|
const qmckl_context context,
|
|
|
|
const bool TransA,
|
|
|
|
const bool TransB,
|
|
|
|
const int64_t m,
|
|
|
|
const int64_t n,
|
|
|
|
const int64_t k,
|
|
|
|
const double alpha,
|
|
|
|
const double* A,
|
|
|
|
const int64_t lda,
|
|
|
|
const double* B,
|
|
|
|
const int64_t ldb,
|
|
|
|
const double beta,
|
|
|
|
double* const C,
|
2021-10-14 21:53:00 +02:00
|
|
|
const int64_t ldc );
|
2021-09-07 16:36:26 +02:00
|
|
|
#+END_src
|
|
|
|
|
|
|
|
*** Source
|
|
|
|
#+begin_src f90 :tangle (eval f)
|
|
|
|
integer function qmckl_dgemm_f(context, TransA, TransB, m, n, k, alpha, A, LDA, B, LDB, beta, C, LDC) &
|
|
|
|
result(info)
|
|
|
|
use qmckl
|
|
|
|
implicit none
|
|
|
|
integer(qmckl_context) , intent(in) :: context
|
2021-09-15 11:55:45 +02:00
|
|
|
logical*8 , intent(in) :: TransA, TransB
|
2021-09-07 16:36:26 +02:00
|
|
|
integer*8 , intent(in) :: m, n, k
|
2021-09-15 11:55:45 +02:00
|
|
|
real*8 , intent(in) :: alpha, beta
|
2021-09-07 16:36:26 +02:00
|
|
|
integer*8 , intent(in) :: lda
|
2021-09-15 16:21:42 +02:00
|
|
|
real*8 , intent(in) :: A(m,k)
|
2021-09-07 16:36:26 +02:00
|
|
|
integer*8 , intent(in) :: ldb
|
2021-09-15 16:21:42 +02:00
|
|
|
real*8 , intent(in) :: B(k,n)
|
2021-09-07 16:36:26 +02:00
|
|
|
integer*8 , intent(in) :: ldc
|
2021-09-15 11:55:45 +02:00
|
|
|
real*8 , intent(out) :: C(m,n)
|
2021-09-27 18:16:51 +02:00
|
|
|
real*8, allocatable :: AT(:,:), BT(:,:), CT(:,:)
|
2021-09-07 16:36:26 +02:00
|
|
|
|
2021-09-27 18:16:51 +02:00
|
|
|
integer*8 :: i,j,l, LDA_2, LDB_2
|
2021-09-07 16:36:26 +02:00
|
|
|
|
|
|
|
info = QMCKL_SUCCESS
|
|
|
|
|
2021-09-27 18:16:51 +02:00
|
|
|
if (TransA) then
|
|
|
|
allocate(AT(k,m))
|
|
|
|
do i = 1, m
|
|
|
|
do j = 1, k
|
|
|
|
AT(j,i) = A(i,j)
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
LDA_2 = M
|
|
|
|
else
|
|
|
|
LDA_2 = LDA
|
|
|
|
endif
|
|
|
|
|
|
|
|
if (TransB) then
|
|
|
|
allocate(BT(n,k))
|
|
|
|
do i = 1, k
|
|
|
|
do j = 1, n
|
|
|
|
BT(j,i) = B(i,j)
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
LDB_2 = K
|
|
|
|
else
|
|
|
|
LDB_2 = LDB
|
|
|
|
endif
|
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
if (context == QMCKL_NULL_CONTEXT) then
|
|
|
|
info = QMCKL_INVALID_CONTEXT
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
|
|
|
if (m <= 0_8) then
|
|
|
|
info = QMCKL_INVALID_ARG_4
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
|
|
|
if (n <= 0_8) then
|
|
|
|
info = QMCKL_INVALID_ARG_5
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
|
|
|
if (k <= 0_8) then
|
|
|
|
info = QMCKL_INVALID_ARG_6
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
2021-10-17 17:57:15 +02:00
|
|
|
if (LDA_2 /= m) then
|
2021-09-07 16:36:26 +02:00
|
|
|
info = QMCKL_INVALID_ARG_9
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
2021-10-17 17:57:15 +02:00
|
|
|
if (LDB_2 /= k) then
|
2021-09-07 16:36:26 +02:00
|
|
|
info = QMCKL_INVALID_ARG_10
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
2021-10-17 17:57:15 +02:00
|
|
|
if (LDC /= m) then
|
2021-09-07 16:36:26 +02:00
|
|
|
info = QMCKL_INVALID_ARG_13
|
|
|
|
return
|
|
|
|
endif
|
|
|
|
|
2021-09-27 18:16:51 +02:00
|
|
|
if (TransA) then
|
2021-10-17 19:43:53 +02:00
|
|
|
|
2021-10-15 10:22:47 +02:00
|
|
|
if (alpha .eq. 1.0d0 .and. beta .eq. 0.0d0) then
|
2021-10-14 21:53:00 +02:00
|
|
|
C = matmul(AT,B)
|
|
|
|
else
|
|
|
|
C = beta*C + alpha*matmul(AT,B)
|
|
|
|
endif
|
2021-09-27 18:16:51 +02:00
|
|
|
else if (TransB) then
|
2021-10-15 10:22:47 +02:00
|
|
|
if (alpha .eq. 1.0d0 .and. beta .eq. 0.0d0) then
|
2021-10-14 21:53:00 +02:00
|
|
|
C = matmul(A,BT)
|
|
|
|
else
|
|
|
|
C = beta*C + alpha*matmul(A,BT)
|
|
|
|
endif
|
2021-09-27 18:16:51 +02:00
|
|
|
else
|
2021-10-15 10:22:47 +02:00
|
|
|
if (alpha .eq. 1.0d0 .and. beta .eq. 0.0d0) then
|
2021-10-14 21:53:00 +02:00
|
|
|
C = matmul(A,B)
|
|
|
|
else
|
|
|
|
C = beta*C + alpha*matmul(A,B)
|
|
|
|
endif
|
2021-09-27 18:16:51 +02:00
|
|
|
endif
|
2021-09-07 16:36:26 +02:00
|
|
|
end function qmckl_dgemm_f
|
|
|
|
#+end_src
|
2021-10-11 18:32:00 +02:00
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
*** C interface :noexport:
|
|
|
|
|
|
|
|
#+CALL: generate_c_interface(table=qmckl_dgemm_args,rettyp="qmckl_exit_code",fname="qmckl_dgemm")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+BEGIN_src f90 :tangle (eval f) :comments org :exports none
|
|
|
|
integer(c_int32_t) function qmckl_dgemm &
|
|
|
|
(context, TransA, TransB, m, n, k, alpha, A, lda, B, ldb, beta, C, ldc) &
|
|
|
|
bind(C) result(info)
|
|
|
|
|
|
|
|
use, intrinsic :: iso_c_binding
|
|
|
|
implicit none
|
|
|
|
|
|
|
|
integer (c_int64_t) , intent(in) , value :: context
|
2021-09-27 18:16:51 +02:00
|
|
|
logical*8 , intent(in) , value :: TransA
|
|
|
|
logical*8 , intent(in) , value :: TransB
|
2021-09-07 16:36:26 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: m
|
|
|
|
integer (c_int64_t) , intent(in) , value :: n
|
|
|
|
integer (c_int64_t) , intent(in) , value :: k
|
|
|
|
real (c_double ) , intent(in) , value :: alpha
|
|
|
|
integer (c_int64_t) , intent(in) , value :: lda
|
2021-09-15 11:55:45 +02:00
|
|
|
real (c_double ) , intent(in) :: A(lda,*)
|
2021-09-07 16:36:26 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: ldb
|
2021-09-15 11:55:45 +02:00
|
|
|
real (c_double ) , intent(in) :: B(ldb,*)
|
2021-09-07 16:36:26 +02:00
|
|
|
real (c_double ) , intent(in) , value :: beta
|
|
|
|
integer (c_int64_t) , intent(in) , value :: ldc
|
2021-09-15 11:55:45 +02:00
|
|
|
real (c_double ) , intent(out) :: C(ldc,*)
|
2021-09-07 16:36:26 +02:00
|
|
|
|
|
|
|
integer(c_int32_t), external :: qmckl_dgemm_f
|
|
|
|
info = qmckl_dgemm_f &
|
|
|
|
(context, TransA, TransB, m, n, k, alpha, A, lda, B, ldb, beta, C, ldc)
|
|
|
|
|
|
|
|
end function qmckl_dgemm
|
|
|
|
#+END_src
|
|
|
|
|
|
|
|
|
|
|
|
#+CALL: generate_f_interface(table=qmckl_dgemm_args,rettyp="qmckl_exit_code",fname="qmckl_dgemm")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+begin_src f90 :tangle (eval fh_func) :comments org :exports none
|
|
|
|
interface
|
|
|
|
integer(c_int32_t) function qmckl_dgemm &
|
2021-09-15 11:55:45 +02:00
|
|
|
(context, TransA, TransB, m, n, k, alpha, A, lda, B, ldb, beta, C, ldc) &
|
2021-09-07 16:36:26 +02:00
|
|
|
bind(C)
|
|
|
|
use, intrinsic :: iso_c_binding
|
|
|
|
import
|
|
|
|
implicit none
|
|
|
|
|
|
|
|
integer (c_int64_t) , intent(in) , value :: context
|
2021-09-27 18:16:51 +02:00
|
|
|
logical*8 , intent(in) , value :: TransA
|
|
|
|
logical*8 , intent(in) , value :: TransB
|
2021-09-07 16:36:26 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: m
|
|
|
|
integer (c_int64_t) , intent(in) , value :: n
|
|
|
|
integer (c_int64_t) , intent(in) , value :: k
|
2021-09-15 16:21:42 +02:00
|
|
|
real (c_double ) , intent(in) , value :: alpha
|
2021-09-07 16:36:26 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: lda
|
2021-09-15 11:55:45 +02:00
|
|
|
real (c_double ) , intent(in) :: A(lda,*)
|
2021-09-07 16:36:26 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: ldb
|
2021-09-15 11:55:45 +02:00
|
|
|
real (c_double ) , intent(in) :: B(ldb,*)
|
2021-09-15 16:21:42 +02:00
|
|
|
real (c_double ) , intent(in) , value :: beta
|
2021-09-15 11:55:45 +02:00
|
|
|
integer (c_int64_t) , intent(in) , value :: ldc
|
|
|
|
real (c_double ) , intent(out) :: C(ldc,*)
|
2021-09-07 16:36:26 +02:00
|
|
|
|
|
|
|
end function qmckl_dgemm
|
|
|
|
end interface
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
*** Test :noexport:
|
|
|
|
#+begin_src f90 :tangle (eval f_test)
|
|
|
|
integer(qmckl_exit_code) function test_qmckl_dgemm(context) bind(C)
|
|
|
|
use qmckl
|
|
|
|
implicit none
|
|
|
|
integer(qmckl_context), intent(in), value :: context
|
|
|
|
|
|
|
|
double precision, allocatable :: A(:,:), B(:,:), C(:,:), D(:,:)
|
|
|
|
integer*8 :: m, n, k, LDA, LDB, LDC
|
2021-09-15 11:55:45 +02:00
|
|
|
integer*8 :: i,j,l
|
2021-09-27 18:16:51 +02:00
|
|
|
logical*8 :: TransA, TransB
|
2021-09-15 11:55:45 +02:00
|
|
|
double precision :: x, alpha, beta
|
2021-09-07 16:36:26 +02:00
|
|
|
|
|
|
|
TransA = .False.
|
2021-10-14 21:53:00 +02:00
|
|
|
TransB = .False.
|
2021-09-27 23:36:11 +02:00
|
|
|
m = 1_8
|
2021-09-15 11:55:45 +02:00
|
|
|
k = 4_8
|
|
|
|
n = 6_8
|
2021-09-07 16:36:26 +02:00
|
|
|
LDA = m
|
|
|
|
LDB = k
|
|
|
|
LDC = m
|
|
|
|
|
|
|
|
allocate( A(LDA,k), B(LDB,n) , C(LDC,n), D(LDC,n))
|
|
|
|
|
|
|
|
A = 0.d0
|
|
|
|
B = 0.d0
|
|
|
|
C = 0.d0
|
|
|
|
D = 0.d0
|
2021-09-15 16:21:42 +02:00
|
|
|
alpha = 1.0d0
|
|
|
|
beta = 0.0d0
|
|
|
|
do j=1,k
|
|
|
|
do i=1,m
|
2021-09-07 16:36:26 +02:00
|
|
|
A(i,j) = -10.d0 + dble(i+j)
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
|
2021-09-15 16:21:42 +02:00
|
|
|
do j=1,n
|
|
|
|
do i=1,k
|
2021-09-07 16:36:26 +02:00
|
|
|
B(i,j) = -10.d0 + dble(i+j)
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
|
|
|
|
test_qmckl_dgemm = qmckl_dgemm(context, TransA, TransB, m, n, k, alpha, A, LDA, B, LDB, beta, C, LDC)
|
|
|
|
|
|
|
|
if (test_qmckl_dgemm /= QMCKL_SUCCESS) return
|
|
|
|
|
|
|
|
test_qmckl_dgemm = QMCKL_FAILURE
|
|
|
|
|
|
|
|
x = 0.d0
|
2021-09-15 16:21:42 +02:00
|
|
|
do j=1,n
|
|
|
|
do i=1,m
|
2021-09-07 16:36:26 +02:00
|
|
|
do l=1,k
|
2021-09-15 16:21:42 +02:00
|
|
|
D(i,j) = D(i,j) + A(i,l)*B(l,j)
|
2021-09-07 16:36:26 +02:00
|
|
|
end do
|
|
|
|
x = x + (D(i,j) - C(i,j))**2
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
|
|
|
|
if (dabs(x) <= 1.d-15) then
|
|
|
|
test_qmckl_dgemm = QMCKL_SUCCESS
|
|
|
|
endif
|
|
|
|
|
2021-09-15 16:21:42 +02:00
|
|
|
deallocate(A,B,C,D)
|
2021-09-07 16:36:26 +02:00
|
|
|
end function test_qmckl_dgemm
|
|
|
|
#+end_src
|
2021-10-14 21:53:00 +02:00
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
#+begin_src c :comments link :tangle (eval c_test)
|
|
|
|
qmckl_exit_code test_qmckl_dgemm(qmckl_context context);
|
|
|
|
assert(QMCKL_SUCCESS == test_qmckl_dgemm(context));
|
|
|
|
#+end_src
|
|
|
|
|
2021-10-04 22:45:44 +02:00
|
|
|
** ~qmckl_invert~
|
2021-10-11 18:32:00 +02:00
|
|
|
|
2021-10-04 22:45:44 +02:00
|
|
|
Matrix invert. Given a matrix M, returns a matrix M⁻¹ such that:
|
|
|
|
|
|
|
|
|
|
|
|
\[
|
|
|
|
M · M^{-1} = I
|
|
|
|
\]
|
|
|
|
|
|
|
|
This is a native Fortran implementation hand written (by: A. Scemama)
|
2021-10-07 14:13:40 +02:00
|
|
|
only for small matrices (<=5x5).
|
2021-10-04 22:45:44 +02:00
|
|
|
|
|
|
|
TODO: Add description about the external library dependence.
|
|
|
|
|
|
|
|
#+NAME: qmckl_invert_args
|
|
|
|
| qmckl_context | context | in | Global state |
|
|
|
|
| int64_t | m | in | Number of rows of the input matrix |
|
|
|
|
| int64_t | n | in | Number of columns of the input matrix |
|
|
|
|
| int64_t | lda | in | Leading dimension of array ~A~ |
|
|
|
|
| double | A[][lda] | inout | Array containing the $m \times n$ matrix $A$ |
|
|
|
|
| double | det_l | inout | determinant of A |
|
|
|
|
|
|
|
|
*** Requirements
|
|
|
|
|
|
|
|
- ~context~ is not ~QMCKL_NULL_CONTEXT~
|
|
|
|
- ~m > 0~
|
|
|
|
- ~n > 0~
|
|
|
|
- ~lda >= m~
|
|
|
|
- ~A~ is allocated with at least $m \times n \times 8$ bytes
|
|
|
|
|
|
|
|
*** C header
|
|
|
|
|
|
|
|
#+CALL: generate_c_header(table=qmckl_invert_args,rettyp="qmckl_exit_code",fname="qmckl_invert")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+begin_src c :tangle (eval h_func) :comments org
|
|
|
|
qmckl_exit_code qmckl_invert (
|
|
|
|
const qmckl_context context,
|
|
|
|
const int64_t m,
|
|
|
|
const int64_t n,
|
|
|
|
const int64_t lda,
|
|
|
|
double* A,
|
|
|
|
double det_l );
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
*** Source
|
|
|
|
#+begin_src f90 :tangle (eval f)
|
|
|
|
integer function qmckl_invert_f(context, ma, na, LDA, A, det_l) &
|
|
|
|
result(info)
|
|
|
|
use qmckl
|
|
|
|
implicit none
|
|
|
|
integer(qmckl_context) , intent(in) :: context
|
|
|
|
double precision, intent(inout) :: A (LDA,na)
|
|
|
|
integer*8, intent(in) :: LDA
|
|
|
|
integer*8, intent(in) :: ma
|
|
|
|
integer*8, intent(in) :: na
|
|
|
|
double precision, intent(inout) :: det_l
|
|
|
|
integer :: i,j
|
2021-10-07 14:01:40 +02:00
|
|
|
|
|
|
|
info = QMCKL_SUCCESS
|
|
|
|
|
2021-10-04 22:45:44 +02:00
|
|
|
select case (na)
|
|
|
|
case default
|
|
|
|
!DIR$ forceinline
|
|
|
|
print *," TODO: Implement general invert"
|
|
|
|
stop 0
|
|
|
|
case (5)
|
|
|
|
!DIR$ forceinline
|
|
|
|
call invert5(a,LDA,na,det_l)
|
|
|
|
case (4)
|
|
|
|
!DIR$ forceinline
|
|
|
|
call invert4(a,LDA,na,det_l)
|
|
|
|
case (3)
|
|
|
|
!DIR$ forceinline
|
|
|
|
call invert3(a,LDA,na,det_l)
|
|
|
|
case (2)
|
|
|
|
!DIR$ forceinline
|
|
|
|
call invert2(a,LDA,na,det_l)
|
|
|
|
case (1)
|
|
|
|
!DIR$ forceinline
|
|
|
|
call invert1(a,LDA,na,det_l)
|
|
|
|
case (0)
|
|
|
|
det_l=1.d0
|
|
|
|
end select
|
|
|
|
end function qmckl_invert_f
|
|
|
|
|
|
|
|
subroutine invert1(a,LDA,na,det_l)
|
|
|
|
implicit none
|
|
|
|
double precision, intent(inout) :: a (LDA,na)
|
2021-10-06 17:59:44 +02:00
|
|
|
integer*8, intent(in) :: LDA
|
|
|
|
integer*8, intent(in) :: na
|
2021-10-04 22:45:44 +02:00
|
|
|
double precision, intent(inout) :: det_l
|
|
|
|
|
|
|
|
det_l = a(1,1)
|
|
|
|
a(1,1) = 1.d0
|
|
|
|
end
|
|
|
|
|
|
|
|
subroutine invert2(a,LDA,na,det_l)
|
|
|
|
implicit none
|
|
|
|
double precision :: a (LDA,na)
|
|
|
|
integer*8 :: LDA
|
|
|
|
integer*8 :: na
|
|
|
|
double precision :: det_l
|
|
|
|
double precision :: b(2,2)
|
|
|
|
|
|
|
|
b(1,1) = a(1,1)
|
|
|
|
b(2,1) = a(2,1)
|
|
|
|
b(1,2) = a(1,2)
|
|
|
|
b(2,2) = a(2,2)
|
|
|
|
det_l = a(1,1)*a(2,2) - a(1,2)*a(2,1)
|
|
|
|
a(1,1) = b(2,2)
|
|
|
|
a(2,1) = -b(2,1)
|
|
|
|
a(1,2) = -b(1,2)
|
|
|
|
a(2,2) = b(1,1)
|
|
|
|
end
|
|
|
|
|
|
|
|
subroutine invert3(a,LDA,na,det_l)
|
|
|
|
implicit none
|
|
|
|
double precision, intent(inout) :: a (LDA,na)
|
|
|
|
integer*8, intent(in) :: LDA
|
|
|
|
integer*8, intent(in) :: na
|
|
|
|
double precision, intent(inout) :: det_l
|
|
|
|
double precision :: b(4,3)
|
|
|
|
!DIR$ ATTRIBUTES ALIGN : $IRP_ALIGN :: b
|
|
|
|
integer :: i
|
|
|
|
det_l = a(1,1)*(a(2,2)*a(3,3)-a(2,3)*a(3,2)) &
|
|
|
|
-a(1,2)*(a(2,1)*a(3,3)-a(2,3)*a(3,1)) &
|
|
|
|
+a(1,3)*(a(2,1)*a(3,2)-a(2,2)*a(3,1))
|
|
|
|
do i=1,4
|
|
|
|
b(i,1) = a(i,1)
|
|
|
|
b(i,2) = a(i,2)
|
|
|
|
b(i,3) = a(i,3)
|
|
|
|
enddo
|
|
|
|
a(1,1) = b(2,2)*b(3,3) - b(2,3)*b(3,2)
|
|
|
|
a(2,1) = b(2,3)*b(3,1) - b(2,1)*b(3,3)
|
|
|
|
a(3,1) = b(2,1)*b(3,2) - b(2,2)*b(3,1)
|
|
|
|
|
|
|
|
a(1,2) = b(1,3)*b(3,2) - b(1,2)*b(3,3)
|
|
|
|
a(2,2) = b(1,1)*b(3,3) - b(1,3)*b(3,1)
|
|
|
|
a(3,2) = b(1,2)*b(3,1) - b(1,1)*b(3,2)
|
|
|
|
|
|
|
|
a(1,3) = b(1,2)*b(2,3) - b(1,3)*b(2,2)
|
|
|
|
a(2,3) = b(1,3)*b(2,1) - b(1,1)*b(2,3)
|
|
|
|
a(3,3) = b(1,1)*b(2,2) - b(1,2)*b(2,1)
|
|
|
|
|
|
|
|
end
|
|
|
|
|
|
|
|
subroutine invert4(a,LDA,na,det_l)
|
|
|
|
implicit none
|
|
|
|
double precision, intent(inout) :: a (LDA,na)
|
|
|
|
integer*8, intent(in) :: LDA
|
|
|
|
integer*8, intent(in) :: na
|
|
|
|
double precision, intent(inout) :: det_l
|
|
|
|
double precision :: b(4,4)
|
|
|
|
!DIR$ ATTRIBUTES ALIGN : $IRP_ALIGN :: b
|
|
|
|
integer :: i,j
|
|
|
|
det_l = a(1,1)*(a(2,2)*(a(3,3)*a(4,4)-a(3,4)*a(4,3)) &
|
|
|
|
-a(2,3)*(a(3,2)*a(4,4)-a(3,4)*a(4,2)) &
|
|
|
|
+a(2,4)*(a(3,2)*a(4,3)-a(3,3)*a(4,2))) &
|
|
|
|
-a(1,2)*(a(2,1)*(a(3,3)*a(4,4)-a(3,4)*a(4,3)) &
|
|
|
|
-a(2,3)*(a(3,1)*a(4,4)-a(3,4)*a(4,1)) &
|
|
|
|
+a(2,4)*(a(3,1)*a(4,3)-a(3,3)*a(4,1))) &
|
|
|
|
+a(1,3)*(a(2,1)*(a(3,2)*a(4,4)-a(3,4)*a(4,2)) &
|
|
|
|
-a(2,2)*(a(3,1)*a(4,4)-a(3,4)*a(4,1)) &
|
|
|
|
+a(2,4)*(a(3,1)*a(4,2)-a(3,2)*a(4,1))) &
|
|
|
|
-a(1,4)*(a(2,1)*(a(3,2)*a(4,3)-a(3,3)*a(4,2)) &
|
|
|
|
-a(2,2)*(a(3,1)*a(4,3)-a(3,3)*a(4,1)) &
|
|
|
|
+a(2,3)*(a(3,1)*a(4,2)-a(3,2)*a(4,1)))
|
|
|
|
do i=1,4
|
|
|
|
b(1,i) = a(1,i)
|
|
|
|
b(2,i) = a(2,i)
|
|
|
|
b(3,i) = a(3,i)
|
|
|
|
b(4,i) = a(4,i)
|
|
|
|
enddo
|
|
|
|
|
|
|
|
a(1,1) = b(2,2)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(2,3)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))+b(2,4)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))
|
|
|
|
a(2,1) = -b(2,1)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))+b(2,3)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))-b(2,4)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))
|
|
|
|
a(3,1) = b(2,1)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))-b(2,2)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(2,4)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))
|
|
|
|
a(4,1) = -b(2,1)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))+b(2,2)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))-b(2,3)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))
|
|
|
|
|
|
|
|
a(1,2) = -b(1,2)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))+b(1,3)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))-b(1,4)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))
|
|
|
|
a(2,2) = b(1,1)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(1,3)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(1,4)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))
|
|
|
|
a(3,2) = -b(1,1)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))+b(1,2)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))-b(1,4)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))
|
|
|
|
a(4,2) = b(1,1)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))-b(1,2)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))+b(1,3)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))
|
|
|
|
|
|
|
|
a(1,3) = b(1,2)*(b(2,3)*b(4,4)-b(2,4)*b(4,3))-b(1,3)*(b(2,2)*b(4,4)-b(2,4)*b(4,2))+b(1,4)*(b(2,2)*b(4,3)-b(2,3)*b(4,2))
|
|
|
|
a(2,3) = -b(1,1)*(b(2,3)*b(4,4)-b(2,4)*b(4,3))+b(1,3)*(b(2,1)*b(4,4)-b(2,4)*b(4,1))-b(1,4)*(b(2,1)*b(4,3)-b(2,3)*b(4,1))
|
|
|
|
a(3,3) = b(1,1)*(b(2,2)*b(4,4)-b(2,4)*b(4,2))-b(1,2)*(b(2,1)*b(4,4)-b(2,4)*b(4,1))+b(1,4)*(b(2,1)*b(4,2)-b(2,2)*b(4,1))
|
|
|
|
a(4,3) = -b(1,1)*(b(2,2)*b(4,3)-b(2,3)*b(4,2))+b(1,2)*(b(2,1)*b(4,3)-b(2,3)*b(4,1))-b(1,3)*(b(2,1)*b(4,2)-b(2,2)*b(4,1))
|
|
|
|
|
|
|
|
a(1,4) = -b(1,2)*(b(2,3)*b(3,4)-b(2,4)*b(3,3))+b(1,3)*(b(2,2)*b(3,4)-b(2,4)*b(3,2))-b(1,4)*(b(2,2)*b(3,3)-b(2,3)*b(3,2))
|
|
|
|
a(2,4) = b(1,1)*(b(2,3)*b(3,4)-b(2,4)*b(3,3))-b(1,3)*(b(2,1)*b(3,4)-b(2,4)*b(3,1))+b(1,4)*(b(2,1)*b(3,3)-b(2,3)*b(3,1))
|
|
|
|
a(3,4) = -b(1,1)*(b(2,2)*b(3,4)-b(2,4)*b(3,2))+b(1,2)*(b(2,1)*b(3,4)-b(2,4)*b(3,1))-b(1,4)*(b(2,1)*b(3,2)-b(2,2)*b(3,1))
|
|
|
|
a(4,4) = b(1,1)*(b(2,2)*b(3,3)-b(2,3)*b(3,2))-b(1,2)*(b(2,1)*b(3,3)-b(2,3)*b(3,1))+b(1,3)*(b(2,1)*b(3,2)-b(2,2)*b(3,1))
|
|
|
|
|
|
|
|
end
|
|
|
|
|
|
|
|
subroutine invert5(a,LDA,na,det_l)
|
|
|
|
implicit none
|
|
|
|
double precision, intent(inout) :: a (LDA,na)
|
|
|
|
integer*8, intent(in) :: LDA
|
|
|
|
integer*8, intent(in) :: na
|
|
|
|
double precision, intent(inout) :: det_l
|
|
|
|
double precision :: b(5,5)
|
|
|
|
!DIR$ ATTRIBUTES ALIGN : $IRP_ALIGN :: b
|
|
|
|
integer :: i,j
|
|
|
|
det_l = a(1,1)*(a(2,2)*(a(3,3)*(a(4,4)*a(5,5)-a(4,5)*a(5,4))-a(3,4)*( &
|
|
|
|
a(4,3)*a(5,5)-a(4,5)*a(5,3))+a(3,5)*(a(4,3)*a(5,4)-a(4,4)*a(5,3)))- &
|
|
|
|
a(2,3)*(a(3,2)*(a(4,4)*a(5,5)-a(4,5)*a(5,4))-a(3,4)*(a(4,2)*a(5,5)- &
|
|
|
|
a(4,5)*a(5,2))+a(3,5)*(a(4,2)*a(5,4)-a(4,4)*a(5,2)))+a(2,4)*(a(3,2)*( &
|
|
|
|
a(4,3)*a(5,5)-a(4,5)*a(5,3))-a(3,3)*(a(4,2)*a(5,5)-a(4,5)*a(5,2))+ &
|
|
|
|
a(3,5)*(a(4,2)*a(5,3)-a(4,3)*a(5,2)))-a(2,5)*(a(3,2)*(a(4,3)*a(5,4)- &
|
|
|
|
a(4,4)*a(5,3))-a(3,3)*(a(4,2)*a(5,4)-a(4,4)*a(5,2))+a(3,4)*(a(4,2)* &
|
|
|
|
a(5,3)-a(4,3)*a(5,2))))-a(1,2)*(a(2,1)*(a(3,3)*(a(4,4)*a(5,5)-a(4,5)* &
|
|
|
|
a(5,4))-a(3,4)*(a(4,3)*a(5,5)-a(4,5)*a(5,3))+a(3,5)*(a(4,3)*a(5,4)- &
|
|
|
|
a(4,4)*a(5,3)))-a(2,3)*(a(3,1)*(a(4,4)*a(5,5)-a(4,5)*a(5,4))-a(3,4)*( &
|
|
|
|
a(4,1)*a(5,5)-a(4,5)*a(5,1))+a(3,5)*(a(4,1)*a(5,4)-a(4,4)*a(5,1)))+ &
|
|
|
|
a(2,4)*(a(3,1)*(a(4,3)*a(5,5)-a(4,5)*a(5,3))-a(3,3)*(a(4,1)*a(5,5)- &
|
|
|
|
a(4,5)*a(5,1))+a(3,5)*(a(4,1)*a(5,3)-a(4,3)*a(5,1)))-a(2,5)*(a(3,1)*( &
|
|
|
|
a(4,3)*a(5,4)-a(4,4)*a(5,3))-a(3,3)*(a(4,1)*a(5,4)-a(4,4)*a(5,1))+ &
|
|
|
|
a(3,4)*(a(4,1)*a(5,3)-a(4,3)*a(5,1))))+a(1,3)*(a(2,1)*(a(3,2)*(a(4,4)* &
|
|
|
|
a(5,5)-a(4,5)*a(5,4))-a(3,4)*(a(4,2)*a(5,5)-a(4,5)*a(5,2))+a(3,5)*( &
|
|
|
|
a(4,2)*a(5,4)-a(4,4)*a(5,2)))-a(2,2)*(a(3,1)*(a(4,4)*a(5,5)-a(4,5)* &
|
|
|
|
a(5,4))-a(3,4)*(a(4,1)*a(5,5)-a(4,5)*a(5,1))+a(3,5)*(a(4,1)*a(5,4)- &
|
|
|
|
a(4,4)*a(5,1)))+a(2,4)*(a(3,1)*(a(4,2)*a(5,5)-a(4,5)*a(5,2))-a(3,2)*( &
|
|
|
|
a(4,1)*a(5,5)-a(4,5)*a(5,1))+a(3,5)*(a(4,1)*a(5,2)-a(4,2)*a(5,1)))- &
|
|
|
|
a(2,5)*(a(3,1)*(a(4,2)*a(5,4)-a(4,4)*a(5,2))-a(3,2)*(a(4,1)*a(5,4)- &
|
|
|
|
a(4,4)*a(5,1))+a(3,4)*(a(4,1)*a(5,2)-a(4,2)*a(5,1))))-a(1,4)*(a(2,1)*( &
|
|
|
|
a(3,2)*(a(4,3)*a(5,5)-a(4,5)*a(5,3))-a(3,3)*(a(4,2)*a(5,5)-a(4,5)* &
|
|
|
|
a(5,2))+a(3,5)*(a(4,2)*a(5,3)-a(4,3)*a(5,2)))-a(2,2)*(a(3,1)*(a(4,3)* &
|
|
|
|
a(5,5)-a(4,5)*a(5,3))-a(3,3)*(a(4,1)*a(5,5)-a(4,5)*a(5,1))+a(3,5)*( &
|
|
|
|
a(4,1)*a(5,3)-a(4,3)*a(5,1)))+a(2,3)*(a(3,1)*(a(4,2)*a(5,5)-a(4,5)* &
|
|
|
|
a(5,2))-a(3,2)*(a(4,1)*a(5,5)-a(4,5)*a(5,1))+a(3,5)*(a(4,1)*a(5,2)- &
|
|
|
|
a(4,2)*a(5,1)))-a(2,5)*(a(3,1)*(a(4,2)*a(5,3)-a(4,3)*a(5,2))-a(3,2)*( &
|
|
|
|
a(4,1)*a(5,3)-a(4,3)*a(5,1))+a(3,3)*(a(4,1)*a(5,2)-a(4,2)*a(5,1))))+ &
|
|
|
|
a(1,5)*(a(2,1)*(a(3,2)*(a(4,3)*a(5,4)-a(4,4)*a(5,3))-a(3,3)*(a(4,2)* &
|
|
|
|
a(5,4)-a(4,4)*a(5,2))+a(3,4)*(a(4,2)*a(5,3)-a(4,3)*a(5,2)))-a(2,2)*( &
|
|
|
|
a(3,1)*(a(4,3)*a(5,4)-a(4,4)*a(5,3))-a(3,3)*(a(4,1)*a(5,4)-a(4,4)* &
|
|
|
|
a(5,1))+a(3,4)*(a(4,1)*a(5,3)-a(4,3)*a(5,1)))+a(2,3)*(a(3,1)*(a(4,2)* &
|
|
|
|
a(5,4)-a(4,4)*a(5,2))-a(3,2)*(a(4,1)*a(5,4)-a(4,4)*a(5,1))+a(3,4)*( &
|
|
|
|
a(4,1)*a(5,2)-a(4,2)*a(5,1)))-a(2,4)*(a(3,1)*(a(4,2)*a(5,3)-a(4,3)* &
|
|
|
|
a(5,2))-a(3,2)*(a(4,1)*a(5,3)-a(4,3)*a(5,1))+a(3,3)*(a(4,1)*a(5,2)- &
|
|
|
|
a(4,2)*a(5,1))))
|
|
|
|
|
|
|
|
do i=1,5
|
|
|
|
b(1,i) = a(1,i)
|
|
|
|
b(2,i) = a(2,i)
|
|
|
|
b(3,i) = a(3,i)
|
|
|
|
b(4,i) = a(4,i)
|
|
|
|
b(5,i) = a(5,i)
|
|
|
|
enddo
|
|
|
|
|
|
|
|
a(1,1) = &
|
|
|
|
(b(2,2)*(b(3,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(3,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))-b(2,3)* &
|
|
|
|
(b(3,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))+b(2,4)* &
|
|
|
|
(b(3,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))-b(2,5)* &
|
|
|
|
(b(3,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(3,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))))
|
|
|
|
a(2,1) = &
|
|
|
|
(-b(2,1)*(b(3,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(3,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))+b(2,3)* &
|
|
|
|
(b(3,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))-b(2,4)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))+b(2,5)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))))
|
|
|
|
a(3,1) = &
|
|
|
|
(b(2,1)*(b(3,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))-b(2,2)* &
|
|
|
|
(b(3,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))+b(2,4)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(3,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))-b(2,5)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(3,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(4,1) = &
|
|
|
|
(-b(2,1)*(b(3,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))+b(2,2)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))-b(2,3)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(3,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))+b(2,5)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(3,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(3,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(5,1) = &
|
|
|
|
(b(2,1)*(b(3,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(3,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))-b(2,2)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))+b(2,3)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(3,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))-b(2,4)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(3,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(3,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
|
|
|
|
a(1,2) = &
|
|
|
|
(-b(1,2)*(b(3,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(3,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))+b(1,3)* &
|
|
|
|
(b(3,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))-b(1,4)* &
|
|
|
|
(b(3,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))+b(1,5)* &
|
|
|
|
(b(3,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(3,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))))
|
|
|
|
a(2,2) = &
|
|
|
|
(b(1,1)*(b(3,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(3,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))-b(1,3)* &
|
|
|
|
(b(3,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))+b(1,4)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))-b(1,5)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))))
|
|
|
|
a(3,2) = &
|
|
|
|
(-b(1,1)*(b(3,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))+b(1,2)* &
|
|
|
|
(b(3,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(3,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))-b(1,4)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(3,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))+b(1,5)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(3,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(4,2) = &
|
|
|
|
(b(1,1)*(b(3,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(3,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))-b(1,2)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(3,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))+b(1,3)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(3,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(3,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))-b(1,5)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(3,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(3,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(5,2) = &
|
|
|
|
(-b(1,1)*(b(3,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(3,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))+b(1,2)* &
|
|
|
|
(b(3,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(3,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))-b(1,3)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(3,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(3,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))+b(1,4)* &
|
|
|
|
(b(3,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(3,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(3,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
|
|
|
|
a(1,3) = &
|
|
|
|
(b(1,2)*(b(2,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(2,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))-b(1,3)* &
|
|
|
|
(b(2,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(2,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))+b(1,4)* &
|
|
|
|
(b(2,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(2,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(2,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))-b(1,5)* &
|
|
|
|
(b(2,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(2,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(2,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))))
|
|
|
|
a(2,3) = &
|
|
|
|
(-b(1,1)*(b(2,3)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))+b(2,5)*(b(4,3)*b(5,4)-b(4,4)*b(5,3)))+b(1,3)* &
|
|
|
|
(b(2,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))-b(1,4)* &
|
|
|
|
(b(2,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(2,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))+b(1,5)* &
|
|
|
|
(b(2,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(2,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(2,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))))
|
|
|
|
a(3,3) = &
|
|
|
|
(b(1,1)*(b(2,2)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(2,5)*(b(4,2)*b(5,4)-b(4,4)*b(5,2)))-b(1,2)* &
|
|
|
|
(b(2,1)*(b(4,4)*b(5,5)-b(4,5)*b(5,4))-b(2,4)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,4)-b(4,4)*b(5,1)))+b(1,4)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(2,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))-b(1,5)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(2,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(2,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(4,3) = &
|
|
|
|
(-b(1,1)*(b(2,2)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(2,3)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))+b(2,5)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))+b(1,2)* &
|
|
|
|
(b(2,1)*(b(4,3)*b(5,5)-b(4,5)*b(5,3))-b(2,3)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))-b(1,3)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,5)-b(4,5)*b(5,2))-b(2,2)*(b(4,1)*b(5,5)-b(4,5)*b(5,1))+b(2,5)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))+b(1,5)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(2,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(2,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
a(5,3) = &
|
|
|
|
(b(1,1)*(b(2,2)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(2,3)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))+b(2,4)*(b(4,2)*b(5,3)-b(4,3)*b(5,2)))-b(1,2)* &
|
|
|
|
(b(2,1)*(b(4,3)*b(5,4)-b(4,4)*b(5,3))-b(2,3)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(2,4)*(b(4,1)*b(5,3)-b(4,3)*b(5,1)))+b(1,3)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,4)-b(4,4)*b(5,2))-b(2,2)*(b(4,1)*b(5,4)-b(4,4)*b(5,1))+b(2,4)*(b(4,1)*b(5,2)-b(4,2)*b(5,1)))-b(1,4)* &
|
|
|
|
(b(2,1)*(b(4,2)*b(5,3)-b(4,3)*b(5,2))-b(2,2)*(b(4,1)*b(5,3)-b(4,3)*b(5,1))+b(2,3)*(b(4,1)*b(5,2)-b(4,2)*b(5,1))))
|
|
|
|
|
|
|
|
a(1,4) = &
|
|
|
|
(-b(1,2)*(b(2,3)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))+b(2,5)*(b(3,3)*b(5,4)-b(3,4)*b(5,3)))+b(1,3)* &
|
|
|
|
(b(2,2)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))+b(2,5)*(b(3,2)*b(5,4)-b(3,4)*b(5,2)))-b(1,4)* &
|
|
|
|
(b(2,2)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))-b(2,3)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))+b(2,5)*(b(3,2)*b(5,3)-b(3,3)*b(5,2)))+b(1,5)* &
|
|
|
|
(b(2,2)*(b(3,3)*b(5,4)-b(3,4)*b(5,3))-b(2,3)*(b(3,2)*b(5,4)-b(3,4)*b(5,2))+b(2,4)*(b(3,2)*b(5,3)-b(3,3)*b(5,2))))
|
|
|
|
a(2,4) = &
|
|
|
|
(b(1,1)*(b(2,3)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))+b(2,5)*(b(3,3)*b(5,4)-b(3,4)*b(5,3)))-b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,4)-b(3,4)*b(5,1)))+b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))-b(2,3)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,3)-b(3,3)*b(5,1)))-b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(5,4)-b(3,4)*b(5,3))-b(2,3)*(b(3,1)*b(5,4)-b(3,4)*b(5,1))+b(2,4)*(b(3,1)*b(5,3)-b(3,3)*b(5,1))))
|
|
|
|
a(3,4) = &
|
|
|
|
(-b(1,1)*(b(2,2)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))+b(2,5)*(b(3,2)*b(5,4)-b(3,4)*b(5,2)))+b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,4)*b(5,5)-b(3,5)*b(5,4))-b(2,4)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,4)-b(3,4)*b(5,1)))-b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))-b(2,2)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,2)-b(3,2)*b(5,1)))+b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,4)-b(3,4)*b(5,2))-b(2,2)*(b(3,1)*b(5,4)-b(3,4)*b(5,1))+b(2,4)*(b(3,1)*b(5,2)-b(3,2)*b(5,1))))
|
|
|
|
a(4,4) = &
|
|
|
|
(b(1,1)*(b(2,2)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))-b(2,3)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))+b(2,5)*(b(3,2)*b(5,3)-b(3,3)*b(5,2)))-b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(5,5)-b(3,5)*b(5,3))-b(2,3)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,3)-b(3,3)*b(5,1)))+b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,5)-b(3,5)*b(5,2))-b(2,2)*(b(3,1)*b(5,5)-b(3,5)*b(5,1))+b(2,5)*(b(3,1)*b(5,2)-b(3,2)*b(5,1)))-b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,3)-b(3,3)*b(5,2))-b(2,2)*(b(3,1)*b(5,3)-b(3,3)*b(5,1))+b(2,3)*(b(3,1)*b(5,2)-b(3,2)*b(5,1))))
|
|
|
|
a(5,4) = &
|
|
|
|
(-b(1,1)*(b(2,2)*(b(3,3)*b(5,4)-b(3,4)*b(5,3))-b(2,3)*(b(3,2)*b(5,4)-b(3,4)*b(5,2))+b(2,4)*(b(3,2)*b(5,3)-b(3,3)*b(5,2)))+b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(5,4)-b(3,4)*b(5,3))-b(2,3)*(b(3,1)*b(5,4)-b(3,4)*b(5,1))+b(2,4)*(b(3,1)*b(5,3)-b(3,3)*b(5,1)))-b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,4)-b(3,4)*b(5,2))-b(2,2)*(b(3,1)*b(5,4)-b(3,4)*b(5,1))+b(2,4)*(b(3,1)*b(5,2)-b(3,2)*b(5,1)))+b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(5,3)-b(3,3)*b(5,2))-b(2,2)*(b(3,1)*b(5,3)-b(3,3)*b(5,1))+b(2,3)*(b(3,1)*b(5,2)-b(3,2)*b(5,1))))
|
|
|
|
|
|
|
|
a(1,5) = &
|
|
|
|
(b(1,2)*(b(2,3)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))+b(2,5)*(b(3,3)*b(4,4)-b(3,4)*b(4,3)))-b(1,3)* &
|
|
|
|
(b(2,2)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))+b(2,5)*(b(3,2)*b(4,4)-b(3,4)*b(4,2)))+b(1,4)* &
|
|
|
|
(b(2,2)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))-b(2,3)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))+b(2,5)*(b(3,2)*b(4,3)-b(3,3)*b(4,2)))-b(1,5)* &
|
|
|
|
(b(2,2)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(2,3)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))+b(2,4)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))))
|
|
|
|
a(2,5) = &
|
|
|
|
(-b(1,1)*(b(2,3)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))+b(2,5)*(b(3,3)*b(4,4)-b(3,4)*b(4,3)))+b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,4)-b(3,4)*b(4,1)))-b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))-b(2,3)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,3)-b(3,3)*b(4,1)))+b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(2,3)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(2,4)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))))
|
|
|
|
a(3,5) = &
|
|
|
|
(b(1,1)*(b(2,2)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))+b(2,5)*(b(3,2)*b(4,4)-b(3,4)*b(4,2)))-b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,4)*b(4,5)-b(3,5)*b(4,4))-b(2,4)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,4)-b(3,4)*b(4,1)))+b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))-b(2,2)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,2)-b(3,2)*b(4,1)))-b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))-b(2,2)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(2,4)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))))
|
|
|
|
a(4,5) = &
|
|
|
|
(-b(1,1)*(b(2,2)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))-b(2,3)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))+b(2,5)*(b(3,2)*b(4,3)-b(3,3)*b(4,2)))+b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(4,5)-b(3,5)*b(4,3))-b(2,3)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,3)-b(3,3)*b(4,1)))-b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,5)-b(3,5)*b(4,2))-b(2,2)*(b(3,1)*b(4,5)-b(3,5)*b(4,1))+b(2,5)*(b(3,1)*b(4,2)-b(3,2)*b(4,1)))+b(1,5)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))-b(2,2)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))+b(2,3)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))))
|
|
|
|
a(5,5) = &
|
|
|
|
(b(1,1)*(b(2,2)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(2,3)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))+b(2,4)*(b(3,2)*b(4,3)-b(3,3)*b(4,2)))-b(1,2)* &
|
|
|
|
(b(2,1)*(b(3,3)*b(4,4)-b(3,4)*b(4,3))-b(2,3)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(2,4)*(b(3,1)*b(4,3)-b(3,3)*b(4,1)))+b(1,3)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,4)-b(3,4)*b(4,2))-b(2,2)*(b(3,1)*b(4,4)-b(3,4)*b(4,1))+b(2,4)*(b(3,1)*b(4,2)-b(3,2)*b(4,1)))-b(1,4)* &
|
|
|
|
(b(2,1)*(b(3,2)*b(4,3)-b(3,3)*b(4,2))-b(2,2)*(b(3,1)*b(4,3)-b(3,3)*b(4,1))+b(2,3)*(b(3,1)*b(4,2)-b(3,2)*b(4,1))))
|
|
|
|
|
|
|
|
end
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
*** C interface :noexport:
|
2021-10-07 14:13:40 +02:00
|
|
|
|
2021-10-04 22:45:44 +02:00
|
|
|
#+CALL: generate_c_interface(table=qmckl_invert_args,rettyp="qmckl_exit_code",fname="qmckl_invert")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+begin_src f90 :tangle (eval f) :comments org :exports none
|
|
|
|
integer(c_int32_t) function qmckl_invert &
|
|
|
|
(context, m, n, lda, A, det_l) &
|
|
|
|
bind(C) result(info)
|
|
|
|
|
|
|
|
use, intrinsic :: iso_c_binding
|
|
|
|
implicit none
|
|
|
|
|
|
|
|
integer (c_int64_t) , intent(in) , value :: context
|
|
|
|
integer (c_int64_t) , intent(in) , value :: m
|
|
|
|
integer (c_int64_t) , intent(in) , value :: n
|
|
|
|
integer (c_int64_t) , intent(in) , value :: lda
|
|
|
|
real (c_double ) , intent(inout) :: A(lda,*)
|
|
|
|
real (c_double ) , intent(inout) :: det_l
|
|
|
|
|
|
|
|
integer(c_int32_t), external :: qmckl_invert_f
|
|
|
|
info = qmckl_invert_f &
|
|
|
|
(context, m, n, lda, A, det_l)
|
|
|
|
|
|
|
|
end function qmckl_invert
|
|
|
|
#+end_src
|
|
|
|
|
2021-10-07 00:26:35 +02:00
|
|
|
#+CALL: generate_f_interface(table=qmckl_invert_args,rettyp="qmckl_exit_code",fname="qmckl_invert")
|
|
|
|
|
|
|
|
#+RESULTS:
|
|
|
|
#+begin_src f90 :tangle (eval fh_func) :comments org :exports none
|
|
|
|
interface
|
|
|
|
integer(c_int32_t) function qmckl_invert &
|
|
|
|
(context, m, n, lda, A, det_l) &
|
|
|
|
bind(C)
|
|
|
|
use, intrinsic :: iso_c_binding
|
|
|
|
import
|
|
|
|
implicit none
|
|
|
|
|
|
|
|
integer (c_int64_t) , intent(in) , value :: context
|
|
|
|
integer (c_int64_t) , intent(in) , value :: m
|
|
|
|
integer (c_int64_t) , intent(in) , value :: n
|
|
|
|
integer (c_int64_t) , intent(in) , value :: lda
|
|
|
|
real (c_double ) , intent(inout) :: A(lda,*)
|
|
|
|
real (c_double ) , intent(inout) :: det_l
|
|
|
|
|
|
|
|
end function qmckl_invert
|
|
|
|
end interface
|
|
|
|
#+end_src
|
2021-10-07 14:13:40 +02:00
|
|
|
|
2021-10-04 22:45:44 +02:00
|
|
|
*** Test :noexport:
|
2021-10-07 14:01:40 +02:00
|
|
|
#+begin_src f90 :tangle (eval f_test)
|
|
|
|
integer(qmckl_exit_code) function test_qmckl_invert(context) bind(C)
|
|
|
|
use qmckl
|
|
|
|
implicit none
|
|
|
|
integer(qmckl_context), intent(in), value :: context
|
|
|
|
|
|
|
|
double precision, allocatable :: A(:,:), C(:,:)
|
|
|
|
integer*8 :: m, n, k, LDA, LDB, LDC
|
|
|
|
integer*8 :: i,j,l
|
|
|
|
double precision :: x, det_l, det_l_ref
|
|
|
|
|
|
|
|
m = 4_8
|
|
|
|
k = 4_8
|
|
|
|
LDA = m
|
|
|
|
LDB = m
|
|
|
|
LDC = m
|
|
|
|
|
|
|
|
allocate( A(LDA,k), C(LDC,k))
|
|
|
|
|
|
|
|
A = 0.10d0
|
|
|
|
C = 0.d0
|
|
|
|
A(1,1) = 1.0d0;
|
|
|
|
A(2,2) = 2.0d0;
|
|
|
|
A(3,3) = 3.0d0;
|
|
|
|
A(4,4) = 4.0d0;
|
|
|
|
|
|
|
|
! Exact inverse (Mathematica)
|
|
|
|
C(1,1) = 1.0102367161391992d0
|
|
|
|
C(2,2) = 0.5036819224578257d0
|
|
|
|
C(3,3) = 0.33511197860555897d0
|
|
|
|
C(4,4) = 0.2510382472105688d0
|
|
|
|
C(1,2) = -0.047782608144589914d0
|
|
|
|
C(1,3) = -0.031305846715420985d0
|
|
|
|
C(1,4) = -0.023278706531979707d0
|
|
|
|
C(2,3) = -0.014829085286252043d0
|
|
|
|
C(2,4) = -0.011026755725674596d0
|
|
|
|
C(3,4) = -0.007224426165097149d0
|
|
|
|
C(2,1) = -0.047782608144589914d0
|
|
|
|
C(3,1) = -0.031305846715420985d0
|
|
|
|
C(4,1) = -0.023278706531979707d0
|
|
|
|
C(3,2) = -0.014829085286252043d0
|
|
|
|
C(4,2) = -0.011026755725674596d0
|
|
|
|
C(4,3) = -0.007224426165097149d0
|
|
|
|
det_l_ref = 23.6697d0
|
|
|
|
|
|
|
|
test_qmckl_invert = qmckl_invert(context, m, k, LDA, A, det_l)
|
|
|
|
|
|
|
|
if (test_qmckl_invert /= QMCKL_SUCCESS) return
|
|
|
|
|
|
|
|
test_qmckl_invert = QMCKL_FAILURE
|
|
|
|
|
|
|
|
x = 0.d0
|
|
|
|
do j=1,m
|
|
|
|
do i=1,k
|
|
|
|
x = x + (A(i,j) - (C(i,j) * det_l_ref))**2
|
|
|
|
end do
|
|
|
|
end do
|
|
|
|
|
|
|
|
if (dabs(x) <= 1.d-15 .and. (dabs(det_l_ref - det_l)) <= 1.d-15) then
|
|
|
|
test_qmckl_invert = QMCKL_SUCCESS
|
|
|
|
endif
|
|
|
|
|
|
|
|
deallocate(A,C)
|
|
|
|
end function test_qmckl_invert
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
#+begin_src c :comments link :tangle (eval c_test)
|
|
|
|
qmckl_exit_code test_qmckl_invert(qmckl_context context);
|
|
|
|
assert(QMCKL_SUCCESS == test_qmckl_invert(context));
|
|
|
|
#+end_src
|
2021-10-04 22:45:44 +02:00
|
|
|
|
2021-09-07 16:36:26 +02:00
|
|
|
* End of files :noexport:
|
|
|
|
|
|
|
|
#+begin_src c :comments link :tangle (eval c_test)
|
|
|
|
assert (qmckl_context_destroy(context) == QMCKL_SUCCESS);
|
|
|
|
return 0;
|
|
|
|
}
|
|
|
|
|
|
|
|
#+end_src
|
|
|
|
|
|
|
|
|
|
|
|
# -*- mode: org -*-
|
|
|
|
# vim: syntax=c
|