Files
lammps/lib/linalg/dlaed0.cpp
Axel Kohlmeyer 1e8b2ad5a0 whitespace fixes
2022-12-28 13:48:43 -05:00

535 lines
17 KiB
C++

/* fortran/dlaed0.f -- translated by f2c (version 20200916).
You must link the resulting object file with libf2c:
on Microsoft Windows system, link with libf2c.lib;
on Linux or Unix systems, link with .../path/to/libf2c.a -lm
or, if you install libf2c.a in a standard place, with -lf2c -lm
-- in that order, at the end of the command line, as in
cc *.o -lf2c -lm
Source for libf2c is in /netlib/f2c/libf2c.zip, e.g.,
http://www.netlib.org/f2c/libf2c.zip
*/
#ifdef __cplusplus
extern "C" {
#endif
#include "lmp_f2c.h"
/* Table of constant values */
static integer c__9 = 9;
static integer c__0 = 0;
static integer c__2 = 2;
static doublereal c_b23 = 1.;
static doublereal c_b24 = 0.;
static integer c__1 = 1;
/* > \brief \b DLAED0 used by DSTEDC. Computes all eigenvalues and corresponding eigenvectors of an unreduced
symmetric tridiagonal matrix using the divide and conquer method. */
/* =========== DOCUMENTATION =========== */
/* Online html documentation available at */
/* http://www.netlib.org/lapack/explore-html/ */
/* > \htmlonly */
/* > Download DLAED0 + dependencies */
/* > <a href="http://www.netlib.org/cgi-bin/netlibfiles.tgz?format=tgz&filename=/lapack/lapack_routine/dlaed0.
f"> */
/* > [TGZ]</a> */
/* > <a href="http://www.netlib.org/cgi-bin/netlibfiles.zip?format=zip&filename=/lapack/lapack_routine/dlaed0.
f"> */
/* > [ZIP]</a> */
/* > <a href="http://www.netlib.org/cgi-bin/netlibfiles.txt?format=txt&filename=/lapack/lapack_routine/dlaed0.
f"> */
/* > [TXT]</a> */
/* > \endhtmlonly */
/* Definition: */
/* =========== */
/* SUBROUTINE DLAED0( ICOMPQ, QSIZ, N, D, E, Q, LDQ, QSTORE, LDQS, */
/* WORK, IWORK, INFO ) */
/* .. Scalar Arguments .. */
/* INTEGER ICOMPQ, INFO, LDQ, LDQS, N, QSIZ */
/* .. */
/* .. Array Arguments .. */
/* INTEGER IWORK( * ) */
/* DOUBLE PRECISION D( * ), E( * ), Q( LDQ, * ), QSTORE( LDQS, * ), */
/* $ WORK( * ) */
/* .. */
/* > \par Purpose: */
/* ============= */
/* > */
/* > \verbatim */
/* > */
/* > DLAED0 computes all eigenvalues and corresponding eigenvectors of a */
/* > symmetric tridiagonal matrix using the divide and conquer method. */
/* > \endverbatim */
/* Arguments: */
/* ========== */
/* > \param[in] ICOMPQ */
/* > \verbatim */
/* > ICOMPQ is INTEGER */
/* > = 0: Compute eigenvalues only. */
/* > = 1: Compute eigenvectors of original dense symmetric matrix */
/* > also. On entry, Q contains the orthogonal matrix used */
/* > to reduce the original matrix to tridiagonal form. */
/* > = 2: Compute eigenvalues and eigenvectors of tridiagonal */
/* > matrix. */
/* > \endverbatim */
/* > */
/* > \param[in] QSIZ */
/* > \verbatim */
/* > QSIZ is INTEGER */
/* > The dimension of the orthogonal matrix used to reduce */
/* > the full matrix to tridiagonal form. QSIZ >= N if ICOMPQ = 1. */
/* > \endverbatim */
/* > */
/* > \param[in] N */
/* > \verbatim */
/* > N is INTEGER */
/* > The dimension of the symmetric tridiagonal matrix. N >= 0. */
/* > \endverbatim */
/* > */
/* > \param[in,out] D */
/* > \verbatim */
/* > D is DOUBLE PRECISION array, dimension (N) */
/* > On entry, the main diagonal of the tridiagonal matrix. */
/* > On exit, its eigenvalues. */
/* > \endverbatim */
/* > */
/* > \param[in] E */
/* > \verbatim */
/* > E is DOUBLE PRECISION array, dimension (N-1) */
/* > The off-diagonal elements of the tridiagonal matrix. */
/* > On exit, E has been destroyed. */
/* > \endverbatim */
/* > */
/* > \param[in,out] Q */
/* > \verbatim */
/* > Q is DOUBLE PRECISION array, dimension (LDQ, N) */
/* > On entry, Q must contain an N-by-N orthogonal matrix. */
/* > If ICOMPQ = 0 Q is not referenced. */
/* > If ICOMPQ = 1 On entry, Q is a subset of the columns of the */
/* > orthogonal matrix used to reduce the full */
/* > matrix to tridiagonal form corresponding to */
/* > the subset of the full matrix which is being */
/* > decomposed at this time. */
/* > If ICOMPQ = 2 On entry, Q will be the identity matrix. */
/* > On exit, Q contains the eigenvectors of the */
/* > tridiagonal matrix. */
/* > \endverbatim */
/* > */
/* > \param[in] LDQ */
/* > \verbatim */
/* > LDQ is INTEGER */
/* > The leading dimension of the array Q. If eigenvectors are */
/* > desired, then LDQ >= max(1,N). In any case, LDQ >= 1. */
/* > \endverbatim */
/* > */
/* > \param[out] QSTORE */
/* > \verbatim */
/* > QSTORE is DOUBLE PRECISION array, dimension (LDQS, N) */
/* > Referenced only when ICOMPQ = 1. Used to store parts of */
/* > the eigenvector matrix when the updating matrix multiplies */
/* > take place. */
/* > \endverbatim */
/* > */
/* > \param[in] LDQS */
/* > \verbatim */
/* > LDQS is INTEGER */
/* > The leading dimension of the array QSTORE. If ICOMPQ = 1, */
/* > then LDQS >= max(1,N). In any case, LDQS >= 1. */
/* > \endverbatim */
/* > */
/* > \param[out] WORK */
/* > \verbatim */
/* > WORK is DOUBLE PRECISION array, */
/* > If ICOMPQ = 0 or 1, the dimension of WORK must be at least */
/* > 1 + 3*N + 2*N*lg N + 3*N**2 */
/* > ( lg( N ) = smallest integer k */
/* > such that 2^k >= N ) */
/* > If ICOMPQ = 2, the dimension of WORK must be at least */
/* > 4*N + N**2. */
/* > \endverbatim */
/* > */
/* > \param[out] IWORK */
/* > \verbatim */
/* > IWORK is INTEGER array, */
/* > If ICOMPQ = 0 or 1, the dimension of IWORK must be at least */
/* > 6 + 6*N + 5*N*lg N. */
/* > ( lg( N ) = smallest integer k */
/* > such that 2^k >= N ) */
/* > If ICOMPQ = 2, the dimension of IWORK must be at least */
/* > 3 + 5*N. */
/* > \endverbatim */
/* > */
/* > \param[out] INFO */
/* > \verbatim */
/* > INFO is INTEGER */
/* > = 0: successful exit. */
/* > < 0: if INFO = -i, the i-th argument had an illegal value. */
/* > > 0: The algorithm failed to compute an eigenvalue while */
/* > working on the submatrix lying in rows and columns */
/* > INFO/(N+1) through mod(INFO,N+1). */
/* > \endverbatim */
/* Authors: */
/* ======== */
/* > \author Univ. of Tennessee */
/* > \author Univ. of California Berkeley */
/* > \author Univ. of Colorado Denver */
/* > \author NAG Ltd. */
/* > \ingroup auxOTHERcomputational */
/* > \par Contributors: */
/* ================== */
/* > */
/* > Jeff Rutter, Computer Science Division, University of California */
/* > at Berkeley, USA */
/* ===================================================================== */
/* Subroutine */ int dlaed0_(integer *icompq, integer *qsiz, integer *n,
doublereal *d__, doublereal *e, doublereal *q, integer *ldq,
doublereal *qstore, integer *ldqs, doublereal *work, integer *iwork,
integer *info)
{
/* System generated locals */
integer q_dim1, q_offset, qstore_dim1, qstore_offset, i__1, i__2;
doublereal d__1;
/* Builtin functions */
double log(doublereal);
integer pow_ii(integer *, integer *);
/* Local variables */
integer i__, j, k, iq, lgn, msd2, smm1, spm1, spm2;
doublereal temp;
integer curr;
extern /* Subroutine */ int dgemm_(char *, char *, integer *, integer *,
integer *, doublereal *, doublereal *, integer *, doublereal *,
integer *, doublereal *, doublereal *, integer *, ftnlen, ftnlen);
integer iperm;
extern /* Subroutine */ int dcopy_(integer *, doublereal *, integer *,
doublereal *, integer *);
integer indxq, iwrem;
extern /* Subroutine */ int dlaed1_(integer *, doublereal *, doublereal *,
integer *, integer *, doublereal *, integer *, doublereal *,
integer *, integer *);
integer iqptr;
extern /* Subroutine */ int dlaed7_(integer *, integer *, integer *,
integer *, integer *, integer *, doublereal *, doublereal *,
integer *, integer *, doublereal *, integer *, doublereal *,
integer *, integer *, integer *, integer *, integer *, doublereal
*, doublereal *, integer *, integer *);
integer tlvls;
extern /* Subroutine */ int dlacpy_(char *, integer *, integer *,
doublereal *, integer *, doublereal *, integer *, ftnlen);
integer igivcl;
extern /* Subroutine */ int xerbla_(char *, integer *, ftnlen);
extern integer ilaenv_(integer *, char *, char *, integer *, integer *,
integer *, integer *, ftnlen, ftnlen);
integer igivnm, submat, curprb, subpbs, igivpt;
extern /* Subroutine */ int dsteqr_(char *, integer *, doublereal *,
doublereal *, doublereal *, integer *, doublereal *, integer *,
ftnlen);
integer curlvl, matsiz, iprmpt, smlsiz;
/* -- LAPACK computational routine -- */
/* -- LAPACK is a software package provided by Univ. of Tennessee, -- */
/* -- Univ. of California Berkeley, Univ. of Colorado Denver and NAG Ltd..-- */
/* .. Scalar Arguments .. */
/* .. */
/* .. Array Arguments .. */
/* .. */
/* ===================================================================== */
/* .. Parameters .. */
/* .. */
/* .. Local Scalars .. */
/* .. */
/* .. External Subroutines .. */
/* .. */
/* .. External Functions .. */
/* .. */
/* .. Intrinsic Functions .. */
/* .. */
/* .. Executable Statements .. */
/* Test the input parameters. */
/* Parameter adjustments */
--d__;
--e;
q_dim1 = *ldq;
q_offset = 1 + q_dim1;
q -= q_offset;
qstore_dim1 = *ldqs;
qstore_offset = 1 + qstore_dim1;
qstore -= qstore_offset;
--work;
--iwork;
/* Function Body */
*info = 0;
if (*icompq < 0 || *icompq > 2) {
*info = -1;
} else if (*icompq == 1 && *qsiz < max(0,*n)) {
*info = -2;
} else if (*n < 0) {
*info = -3;
} else if (*ldq < max(1,*n)) {
*info = -7;
} else if (*ldqs < max(1,*n)) {
*info = -9;
}
if (*info != 0) {
i__1 = -(*info);
xerbla_((char *)"DLAED0", &i__1, (ftnlen)6);
return 0;
}
/* Quick return if possible */
if (*n == 0) {
return 0;
}
smlsiz = ilaenv_(&c__9, (char *)"DLAED0", (char *)" ", &c__0, &c__0, &c__0, &c__0, (
ftnlen)6, (ftnlen)1);
/* Determine the size and placement of the submatrices, and save in */
/* the leading elements of IWORK. */
iwork[1] = *n;
subpbs = 1;
tlvls = 0;
L10:
if (iwork[subpbs] > smlsiz) {
for (j = subpbs; j >= 1; --j) {
iwork[j * 2] = (iwork[j] + 1) / 2;
iwork[(j << 1) - 1] = iwork[j] / 2;
/* L20: */
}
++tlvls;
subpbs <<= 1;
goto L10;
}
i__1 = subpbs;
for (j = 2; j <= i__1; ++j) {
iwork[j] += iwork[j - 1];
/* L30: */
}
/* Divide the matrix into SUBPBS submatrices of size at most SMLSIZ+1 */
/* using rank-1 modifications (cuts). */
spm1 = subpbs - 1;
i__1 = spm1;
for (i__ = 1; i__ <= i__1; ++i__) {
submat = iwork[i__] + 1;
smm1 = submat - 1;
d__[smm1] -= (d__1 = e[smm1], abs(d__1));
d__[submat] -= (d__1 = e[smm1], abs(d__1));
/* L40: */
}
indxq = (*n << 2) + 3;
if (*icompq != 2) {
/* Set up workspaces for eigenvalues only/accumulate new vectors */
/* routine */
temp = log((doublereal) (*n)) / log(2.);
lgn = (integer) temp;
if (pow_ii(&c__2, &lgn) < *n) {
++lgn;
}
if (pow_ii(&c__2, &lgn) < *n) {
++lgn;
}
iprmpt = indxq + *n + 1;
iperm = iprmpt + *n * lgn;
iqptr = iperm + *n * lgn;
igivpt = iqptr + *n + 2;
igivcl = igivpt + *n * lgn;
igivnm = 1;
iq = igivnm + (*n << 1) * lgn;
/* Computing 2nd power */
i__1 = *n;
iwrem = iq + i__1 * i__1 + 1;
/* Initialize pointers */
i__1 = subpbs;
for (i__ = 0; i__ <= i__1; ++i__) {
iwork[iprmpt + i__] = 1;
iwork[igivpt + i__] = 1;
/* L50: */
}
iwork[iqptr] = 1;
}
/* Solve each submatrix eigenproblem at the bottom of the divide and */
/* conquer tree. */
curr = 0;
i__1 = spm1;
for (i__ = 0; i__ <= i__1; ++i__) {
if (i__ == 0) {
submat = 1;
matsiz = iwork[1];
} else {
submat = iwork[i__] + 1;
matsiz = iwork[i__ + 1] - iwork[i__];
}
if (*icompq == 2) {
dsteqr_((char *)"I", &matsiz, &d__[submat], &e[submat], &q[submat +
submat * q_dim1], ldq, &work[1], info, (ftnlen)1);
if (*info != 0) {
goto L130;
}
} else {
dsteqr_((char *)"I", &matsiz, &d__[submat], &e[submat], &work[iq - 1 +
iwork[iqptr + curr]], &matsiz, &work[1], info, (ftnlen)1);
if (*info != 0) {
goto L130;
}
if (*icompq == 1) {
dgemm_((char *)"N", (char *)"N", qsiz, &matsiz, &matsiz, &c_b23, &q[submat *
q_dim1 + 1], ldq, &work[iq - 1 + iwork[iqptr + curr]],
&matsiz, &c_b24, &qstore[submat * qstore_dim1 + 1],
ldqs, (ftnlen)1, (ftnlen)1);
}
/* Computing 2nd power */
i__2 = matsiz;
iwork[iqptr + curr + 1] = iwork[iqptr + curr] + i__2 * i__2;
++curr;
}
k = 1;
i__2 = iwork[i__ + 1];
for (j = submat; j <= i__2; ++j) {
iwork[indxq + j] = k;
++k;
/* L60: */
}
/* L70: */
}
/* Successively merge eigensystems of adjacent submatrices */
/* into eigensystem for the corresponding larger matrix. */
/* while ( SUBPBS > 1 ) */
curlvl = 1;
L80:
if (subpbs > 1) {
spm2 = subpbs - 2;
i__1 = spm2;
for (i__ = 0; i__ <= i__1; i__ += 2) {
if (i__ == 0) {
submat = 1;
matsiz = iwork[2];
msd2 = iwork[1];
curprb = 0;
} else {
submat = iwork[i__] + 1;
matsiz = iwork[i__ + 2] - iwork[i__];
msd2 = matsiz / 2;
++curprb;
}
/* Merge lower order eigensystems (of size MSD2 and MATSIZ - MSD2) */
/* into an eigensystem of size MATSIZ. */
/* DLAED1 is used only for the full eigensystem of a tridiagonal */
/* matrix. */
/* DLAED7 handles the cases in which eigenvalues only or eigenvalues */
/* and eigenvectors of a full symmetric matrix (which was reduced to */
/* tridiagonal form) are desired. */
if (*icompq == 2) {
dlaed1_(&matsiz, &d__[submat], &q[submat + submat * q_dim1],
ldq, &iwork[indxq + submat], &e[submat + msd2 - 1], &
msd2, &work[1], &iwork[subpbs + 1], info);
} else {
dlaed7_(icompq, &matsiz, qsiz, &tlvls, &curlvl, &curprb, &d__[
submat], &qstore[submat * qstore_dim1 + 1], ldqs, &
iwork[indxq + submat], &e[submat + msd2 - 1], &msd2, &
work[iq], &iwork[iqptr], &iwork[iprmpt], &iwork[iperm]
, &iwork[igivpt], &iwork[igivcl], &work[igivnm], &
work[iwrem], &iwork[subpbs + 1], info);
}
if (*info != 0) {
goto L130;
}
iwork[i__ / 2 + 1] = iwork[i__ + 2];
/* L90: */
}
subpbs /= 2;
++curlvl;
goto L80;
}
/* end while */
/* Re-merge the eigenvalues/vectors which were deflated at the final */
/* merge step. */
if (*icompq == 1) {
i__1 = *n;
for (i__ = 1; i__ <= i__1; ++i__) {
j = iwork[indxq + i__];
work[i__] = d__[j];
dcopy_(qsiz, &qstore[j * qstore_dim1 + 1], &c__1, &q[i__ * q_dim1
+ 1], &c__1);
/* L100: */
}
dcopy_(n, &work[1], &c__1, &d__[1], &c__1);
} else if (*icompq == 2) {
i__1 = *n;
for (i__ = 1; i__ <= i__1; ++i__) {
j = iwork[indxq + i__];
work[i__] = d__[j];
dcopy_(n, &q[j * q_dim1 + 1], &c__1, &work[*n * i__ + 1], &c__1);
/* L110: */
}
dcopy_(n, &work[1], &c__1, &d__[1], &c__1);
dlacpy_((char *)"A", n, n, &work[*n + 1], n, &q[q_offset], ldq, (ftnlen)1);
} else {
i__1 = *n;
for (i__ = 1; i__ <= i__1; ++i__) {
j = iwork[indxq + i__];
work[i__] = d__[j];
/* L120: */
}
dcopy_(n, &work[1], &c__1, &d__[1], &c__1);
}
goto L140;
L130:
*info = submat * (*n + 1) + submat + matsiz - 1;
L140:
return 0;
/* End of DLAED0 */
} /* dlaed0_ */
#ifdef __cplusplus
}
#endif