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/* Ergo, version 3.8.2, a program for linear scaling electronic structure
* calculations.
* Copyright (C) 2023 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_LASRT_HEADER
#define TEMPLATE_LAPACK_LASRT_HEADER
template<class Treal>
int template_lapack_lasrt(const char *id, const integer *n, Treal *d__, integer *
info)
{
/* -- LAPACK routine (version 3.0) --
Univ. of Tennessee, Univ. of California Berkeley, NAG Ltd.,
Courant Institute, Argonne National Lab, and Rice University
September 30, 1994
Purpose
=======
Sort the numbers in D in increasing order (if ID = 'I') or
in decreasing order (if ID = 'D' ).
Use Quick Sort, reverting to Insertion sort on arrays of
size <= 20. Dimension of STACK limits N to about 2**32.
Arguments
=========
ID (input) CHARACTER*1
= 'I': sort D in increasing order;
= 'D': sort D in decreasing order.
N (input) INTEGER
The length of the array D.
D (input/output) DOUBLE PRECISION array, dimension (N)
On entry, the array to be sorted.
On exit, D has been sorted into increasing order
(D(1) <= ... <= D(N) ) or into decreasing order
(D(1) >= ... >= D(N) ), depending on ID.
INFO (output) INTEGER
= 0: successful exit
< 0: if INFO = -i, the i-th argument had an illegal value
=====================================================================
Test the input paramters.
Parameter adjustments */
/* System generated locals */
integer i__1, i__2;
/* Local variables */
integer endd, i__, j;
integer stack[64] /* was [2][32] */;
Treal dmnmx, d1, d2, d3;
integer start;
integer stkpnt, dir;
Treal tmp;
#define stack_ref(a_1,a_2) stack[(a_2)*2 + a_1 - 3]
--d__;
/* Function Body */
*info = 0;
dir = -1;
if (template_blas_lsame(id, "D")) {
dir = 0;
} else if (template_blas_lsame(id, "I")) {
dir = 1;
}
if (dir == -1) {
*info = -1;
} else if (*n < 0) {
*info = -2;
}
if (*info != 0) {
i__1 = -(*info);
template_blas_erbla("LASRT ", &i__1);
return 0;
}
/* Quick return if possible */
if (*n <= 1) {
return 0;
}
stkpnt = 1;
stack_ref(1, 1) = 1;
stack_ref(2, 1) = *n;
L10:
start = stack_ref(1, stkpnt);
endd = stack_ref(2, stkpnt);
--stkpnt;
if (endd - start <= 20 && endd - start > 0) {
/* Do Insertion sort on D( START:ENDD ) */
if (dir == 0) {
/* Sort into decreasing order */
i__1 = endd;
for (i__ = start + 1; i__ <= i__1; ++i__) {
i__2 = start + 1;
for (j = i__; j >= i__2; --j) {
if (d__[j] > d__[j - 1]) {
dmnmx = d__[j];
d__[j] = d__[j - 1];
d__[j - 1] = dmnmx;
} else {
goto L30;
}
/* L20: */
}
L30:
;
}
} else {
/* Sort into increasing order */
i__1 = endd;
for (i__ = start + 1; i__ <= i__1; ++i__) {
i__2 = start + 1;
for (j = i__; j >= i__2; --j) {
if (d__[j] < d__[j - 1]) {
dmnmx = d__[j];
d__[j] = d__[j - 1];
d__[j - 1] = dmnmx;
} else {
goto L50;
}
/* L40: */
}
L50:
;
}
}
} else if (endd - start > 20) {
/* Partition D( START:ENDD ) and stack parts, largest one first
Choose partition entry as median of 3 */
d1 = d__[start];
d2 = d__[endd];
i__ = (start + endd) / 2;
d3 = d__[i__];
if (d1 < d2) {
if (d3 < d1) {
dmnmx = d1;
} else if (d3 < d2) {
dmnmx = d3;
} else {
dmnmx = d2;
}
} else {
if (d3 < d2) {
dmnmx = d2;
} else if (d3 < d1) {
dmnmx = d3;
} else {
dmnmx = d1;
}
}
if (dir == 0) {
/* Sort into decreasing order */
i__ = start - 1;
j = endd + 1;
L60:
L70:
--j;
if (d__[j] < dmnmx) {
goto L70;
}
L80:
++i__;
if (d__[i__] > dmnmx) {
goto L80;
}
if (i__ < j) {
tmp = d__[i__];
d__[i__] = d__[j];
d__[j] = tmp;
goto L60;
}
if (j - start > endd - j - 1) {
++stkpnt;
stack_ref(1, stkpnt) = start;
stack_ref(2, stkpnt) = j;
++stkpnt;
stack_ref(1, stkpnt) = j + 1;
stack_ref(2, stkpnt) = endd;
} else {
++stkpnt;
stack_ref(1, stkpnt) = j + 1;
stack_ref(2, stkpnt) = endd;
++stkpnt;
stack_ref(1, stkpnt) = start;
stack_ref(2, stkpnt) = j;
}
} else {
/* Sort into increasing order */
i__ = start - 1;
j = endd + 1;
L90:
L100:
--j;
if (d__[j] > dmnmx) {
goto L100;
}
L110:
++i__;
if (d__[i__] < dmnmx) {
goto L110;
}
if (i__ < j) {
tmp = d__[i__];
d__[i__] = d__[j];
d__[j] = tmp;
goto L90;
}
if (j - start > endd - j - 1) {
++stkpnt;
stack_ref(1, stkpnt) = start;
stack_ref(2, stkpnt) = j;
++stkpnt;
stack_ref(1, stkpnt) = j + 1;
stack_ref(2, stkpnt) = endd;
} else {
++stkpnt;
stack_ref(1, stkpnt) = j + 1;
stack_ref(2, stkpnt) = endd;
++stkpnt;
stack_ref(1, stkpnt) = start;
stack_ref(2, stkpnt) = j;
}
}
}
if (stkpnt > 0) {
goto L10;
}
return 0;
/* End of DLASRT */
} /* dlasrt_ */
#undef stack_ref
#endif
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