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/* Ergo, version 3.8, a program for linear scaling electronic structure
* calculations.
* Copyright (C) 2019 Elias Rudberg, Emanuel H. Rubensson, Pawel Salek,
* and Anastasia Kruchinina.
*
* This program is free software: you can redistribute it and/or modify
* it under the terms of the GNU General Public License as published by
* the Free Software Foundation, either version 3 of the License, or
* (at your option) any later version.
*
* This program 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 General Public License for more details.
*
* You should have received a copy of the GNU General Public License
* along with this program. If not, see <http://www.gnu.org/licenses/>.
*
* Primary academic reference:
* Ergo: An open-source program for linear-scaling electronic structure
* calculations,
* Elias Rudberg, Emanuel H. Rubensson, Pawel Salek, and Anastasia
* Kruchinina,
* SoftwareX 7, 107 (2018),
* <http://dx.doi.org/10.1016/j.softx.2018.03.005>
*
* For further information about Ergo, see <http://www.ergoscf.org>.
*/
/* This file belongs to the template_lapack part of the Ergo source
* code. The source files in the template_lapack directory are modified
* versions of files originally distributed as CLAPACK, see the
* Copyright/license notice in the file template_lapack/COPYING.
*/
#ifndef TEMPLATE_LAPACK_GEQR2_HEADER
#define TEMPLATE_LAPACK_GEQR2_HEADER
template<class Treal>
int template_lapack_geqr2(const integer *m, const integer *n, Treal *a, const integer *
lda, Treal *tau, Treal *work, integer *info)
{
/* -- LAPACK routine (version 3.0) --
Univ. of Tennessee, Univ. of California Berkeley, NAG Ltd.,
Courant Institute, Argonne National Lab, and Rice University
February 29, 1992
Purpose
=======
DGEQR2 computes a QR factorization of a real m by n matrix A:
A = Q * R.
Arguments
=========
M (input) INTEGER
The number of rows of the matrix A. M >= 0.
N (input) INTEGER
The number of columns of the matrix A. N >= 0.
A (input/output) DOUBLE PRECISION array, dimension (LDA,N)
On entry, the m by n matrix A.
On exit, the elements on and above the diagonal of the array
contain the min(m,n) by n upper trapezoidal matrix R (R is
upper triangular if m >= n); the elements below the diagonal,
with the array TAU, represent the orthogonal matrix Q as a
product of elementary reflectors (see Further Details).
LDA (input) INTEGER
The leading dimension of the array A. LDA >= max(1,M).
TAU (output) DOUBLE PRECISION array, dimension (min(M,N))
The scalar factors of the elementary reflectors (see Further
Details).
WORK (workspace) DOUBLE PRECISION array, dimension (N)
INFO (output) INTEGER
= 0: successful exit
< 0: if INFO = -i, the i-th argument had an illegal value
Further Details
===============
The matrix Q is represented as a product of elementary reflectors
Q = H(1) H(2) . . . H(k), where k = min(m,n).
Each H(i) has the form
H(i) = I - tau * v * v'
where tau is a real scalar, and v is a real vector with
v(1:i-1) = 0 and v(i) = 1; v(i+1:m) is stored on exit in A(i+1:m,i),
and tau in TAU(i).
=====================================================================
Test the input arguments
Parameter adjustments */
/* Table of constant values */
integer c__1 = 1;
/* System generated locals */
integer a_dim1, a_offset, i__1, i__2, i__3;
/* Local variables */
integer i__, k;
Treal aii;
#define a_ref(a_1,a_2) a[(a_2)*a_dim1 + a_1]
a_dim1 = *lda;
a_offset = 1 + a_dim1 * 1;
a -= a_offset;
--tau;
--work;
/* Function Body */
*info = 0;
if (*m < 0) {
*info = -1;
} else if (*n < 0) {
*info = -2;
} else if (*lda < maxMACRO(1,*m)) {
*info = -4;
}
if (*info != 0) {
i__1 = -(*info);
template_blas_erbla("GEQR2 ", &i__1);
return 0;
}
k = minMACRO(*m,*n);
i__1 = k;
for (i__ = 1; i__ <= i__1; ++i__) {
/* Generate elementary reflector H(i) to annihilate A(i+1:m,i)
Computing MIN */
i__2 = i__ + 1;
i__3 = *m - i__ + 1;
template_lapack_larfg(&i__3, &a_ref(i__, i__), &a_ref(minMACRO(i__2,*m), i__), &c__1, &
tau[i__]);
if (i__ < *n) {
/* Apply H(i) to A(i:m,i+1:n) from the left */
aii = a_ref(i__, i__);
a_ref(i__, i__) = 1.;
i__2 = *m - i__ + 1;
i__3 = *n - i__;
template_lapack_larf("Left", &i__2, &i__3, &a_ref(i__, i__), &c__1, &tau[i__], &
a_ref(i__, i__ + 1), lda, &work[1]);
a_ref(i__, i__) = aii;
}
/* L10: */
}
return 0;
/* End of DGEQR2 */
} /* dgeqr2_ */
#undef a_ref
#endif
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